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Pyrimidines And Derivatives

Aromatic organic compounds that consist of an aromatic six-membered ring containing two non-adjacent nitrogen atoms and four carbon atoms; includes compounds derived from pyrimidines.

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Guanine, 99+%

CAS: 73-40-5 Molecular Formula: C5H5N5O Molecular Weight (g/mol): 151.13 MDL Number: MFCD00071533 InChI Key: UYTPUPDQBNUYGX-UHFFFAOYSA-N Synonym: guanine,2-amino-6-hydroxypurine,guanin,2-aminohypoxanthine,mearlmaid,pearl essence,guanine enol,stella polaris,dew pearl,natural pearl essence PubChem CID: 764 ChEBI: CHEBI:16235 IUPAC Name: 2-amino-3,7-dihydropurin-6-one SMILES: NC1=NC(=O)C2=C(N1)N=CN2

EDGE
PubChem CID 764
CAS 73-40-5
Molecular Weight (g/mol) 151.13
ChEBI CHEBI:16235
MDL Number MFCD00071533
SMILES NC1=NC(=O)C2=C(N1)N=CN2
Synonym guanine,2-amino-6-hydroxypurine,guanin,2-aminohypoxanthine,mearlmaid,pearl essence,guanine enol,stella polaris,dew pearl,natural pearl essence
IUPAC Name 2-amino-3,7-dihydropurin-6-one
InChI Key UYTPUPDQBNUYGX-UHFFFAOYSA-N
Molecular Formula C5H5N5O
2
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Thermo Scientific Chemicals Uracil, 99+%

CAS: 66-22-8 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00006016 InChI Key: ISAKRJDGNUQOIC-UHFFFAOYSA-N Synonym: uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,2,4-dioxopyrimidine,pyrimidine-2,4 1h,3h-dione,pirod,2,4-pyrimidinedione,pyrod,hybar x PubChem CID: 1174 ChEBI: CHEBI:17568 IUPAC Name: 1H-pyrimidine-2,4-dione SMILES: O=C1NC=CC(=O)N1

PubChem CID 1174
CAS 66-22-8
Molecular Weight (g/mol) 112.09
ChEBI CHEBI:17568
MDL Number MFCD00006016
SMILES O=C1NC=CC(=O)N1
Synonym uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,2,4-dioxopyrimidine,pyrimidine-2,4 1h,3h-dione,pirod,2,4-pyrimidinedione,pyrod,hybar x
IUPAC Name 1H-pyrimidine-2,4-dione
InChI Key ISAKRJDGNUQOIC-UHFFFAOYSA-N
Molecular Formula C4H4N2O2
3

Thermo Scientific Chemicals Imatinib mesylate, 98%

CAS: 220127-57-1 Molecular Formula: C30H35N7O4S Molecular Weight (g/mol): 589.72 MDL Number: MFCD04307699 InChI Key: YLMAHDNUQAMNNX-UHFFFAOYSA-N Synonym: imatinib mesylate,gleevec,glivec,imatinib mesilate,imatinib methanesulfonate,imatinib mesylate sti571,imatinib monomesylate,unii-8a1o1m485b,imatinib, methanesulfonate salt PubChem CID: 123596 ChEBI: CHEBI:31690 IUPAC Name: methanesulfonic acid;4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide SMILES: CS(O)(=O)=O.CN1CCN(CC2=CC=C(C=C2)C(=O)NC2=CC=C(C)C(NC3=NC=CC(=N3)C3=CC=CN=C3)=C2)CC1

PubChem CID 123596
CAS 220127-57-1
Molecular Weight (g/mol) 589.72
ChEBI CHEBI:31690
MDL Number MFCD04307699
SMILES CS(O)(=O)=O.CN1CCN(CC2=CC=C(C=C2)C(=O)NC2=CC=C(C)C(NC3=NC=CC(=N3)C3=CC=CN=C3)=C2)CC1
Synonym imatinib mesylate,gleevec,glivec,imatinib mesilate,imatinib methanesulfonate,imatinib mesylate sti571,imatinib monomesylate,unii-8a1o1m485b,imatinib, methanesulfonate salt
IUPAC Name methanesulfonic acid;4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
InChI Key YLMAHDNUQAMNNX-UHFFFAOYSA-N
Molecular Formula C30H35N7O4S
4

5-(Chloromethyl)uracil, 97%

CAS: 3590-48-5 Molecular Formula: C5H5ClN2O2 Molecular Weight (g/mol): 160.56 MDL Number: MFCD00218445 InChI Key: UCDUBKRXOPMNGH-UHFFFAOYSA-N Synonym: 5-chloromethyl pyrimidine-2,4 1h,3h-dione,5-chloromethyl-1,3-dihydropyrimidine-2,4-dione,2,4 1h,3h-pyrimidinedione, 5-chloromethyl,5-chloromethyluracil,5-chloromethyl uracil,acmc-1ady4,5-chloromethyl-2,4-pyrimidinediol,5-chloromethyl pyrimidine-2,4-diol,5-chloromethyl uracil 250mg PubChem CID: 236125 IUPAC Name: 5-(chloromethyl)-1H-pyrimidine-2,4-dione SMILES: ClCC1=CNC(=O)NC1=O

PubChem CID 236125
CAS 3590-48-5
Molecular Weight (g/mol) 160.56
MDL Number MFCD00218445
SMILES ClCC1=CNC(=O)NC1=O
Synonym 5-chloromethyl pyrimidine-2,4 1h,3h-dione,5-chloromethyl-1,3-dihydropyrimidine-2,4-dione,2,4 1h,3h-pyrimidinedione, 5-chloromethyl,5-chloromethyluracil,5-chloromethyl uracil,acmc-1ady4,5-chloromethyl-2,4-pyrimidinediol,5-chloromethyl pyrimidine-2,4-diol,5-chloromethyl uracil 250mg
IUPAC Name 5-(chloromethyl)-1H-pyrimidine-2,4-dione
InChI Key UCDUBKRXOPMNGH-UHFFFAOYSA-N
Molecular Formula C5H5ClN2O2
5

2',3'-Isopropylideneuridine

CAS: 362-43-6 Molecular Formula: C12H16N2O6 Molecular Weight (g/mol): 284.268 MDL Number: MFCD00034509 InChI Key: GFDUSNQQMOENLR-PEBGCTIMSA-N Synonym: 2',3'-isopropylideneuridine,2',3'-o-isopropylidene uridine,2',3'-o-isopropylideneuridine,1-3ar,4r,6r,6ar-6-hydroxymethyl-2,2-dimethyltetrahydrofuro 3,4-d 1,3 dioxol-4-yl pyrimidine-2,4 1h,3h-dione,1-1r,2r,4r,5r-4-hydroxymethyl-7,7-dimethyl-3,6,8-trioxabicyclo 3.3.0 oct-2-yl-1,3-dihydropyrimidine-2,4-dione,1-3ar,4r,6r,6ar-6-hydroxymethyl-2,2-dimethyl-tetrahydrofuro 3,4-d 1,3 dioxol-4-yl-3h-pyrimidine-2,4-dione,2/',3/'-isopropylideneuridine,2',3'-o-isopropylideneuridine hplc,1-3ar,4r,6r,6ar-6-hydroxymethyl-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro 3,4-d 1,3 dioxol-4-yl pyrimidine-2,4-dione,1-3ar,4r,6r,6ar-6-hydroxymethyl-2,2-dimethyl-tetrahydro-2h-furo 3,4-d 1,3 dioxol-4-yl-1,2,3,4-tetrahydropyrimidine-2,4-dione PubChem CID: 64967 IUPAC Name: 1-[(3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione SMILES: CC1(OC2C(OC(C2O1)N3C=CC(=O)NC3=O)CO)C

PubChem CID 64967
CAS 362-43-6
Molecular Weight (g/mol) 284.268
MDL Number MFCD00034509
SMILES CC1(OC2C(OC(C2O1)N3C=CC(=O)NC3=O)CO)C
Synonym 2',3'-isopropylideneuridine,2',3'-o-isopropylidene uridine,2',3'-o-isopropylideneuridine,1-3ar,4r,6r,6ar-6-hydroxymethyl-2,2-dimethyltetrahydrofuro 3,4-d 1,3 dioxol-4-yl pyrimidine-2,4 1h,3h-dione,1-1r,2r,4r,5r-4-hydroxymethyl-7,7-dimethyl-3,6,8-trioxabicyclo 3.3.0 oct-2-yl-1,3-dihydropyrimidine-2,4-dione,1-3ar,4r,6r,6ar-6-hydroxymethyl-2,2-dimethyl-tetrahydrofuro 3,4-d 1,3 dioxol-4-yl-3h-pyrimidine-2,4-dione,2/',3/'-isopropylideneuridine,2',3'-o-isopropylideneuridine hplc,1-3ar,4r,6r,6ar-6-hydroxymethyl-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro 3,4-d 1,3 dioxol-4-yl pyrimidine-2,4-dione,1-3ar,4r,6r,6ar-6-hydroxymethyl-2,2-dimethyl-tetrahydro-2h-furo 3,4-d 1,3 dioxol-4-yl-1,2,3,4-tetrahydropyrimidine-2,4-dione
IUPAC Name 1-[(3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione
InChI Key GFDUSNQQMOENLR-PEBGCTIMSA-N
Molecular Formula C12H16N2O6
6

5-Amino-4,6-dichloro-2-methylpyrimidine, 97%, Thermo Scientific™

CAS: 39906-04-2 Molecular Formula: C5H5Cl2N3 Molecular Weight (g/mol): 178.02 InChI Key: FKRXXAMAHOGYNT-UHFFFAOYSA-N Synonym: 5-amino-4,6-dichloro-2-methylpyrimidine,2-methyl-4,6-dichloro-5-aminopyrimidine,4,6-dichloro-2-methyl-pyrimidin-5-ylamine,5-pyrimidinamine, 4,6-dichloro-2-methyl,4,6-dichloro-2-methyl-pyrimidin-5-amine,4,6-dichloro-2-methylpyrimidin-5-ylamine,pubchem6960,acmc-209j8x,ksc496o2d,fkrxxamahogynt-uhfffaoysa PubChem CID: 736674 IUPAC Name: 4,6-dichloro-2-methylpyrimidin-5-amine SMILES: CC1=NC(=C(C(=N1)Cl)N)Cl

PubChem CID 736674
CAS 39906-04-2
Molecular Weight (g/mol) 178.02
SMILES CC1=NC(=C(C(=N1)Cl)N)Cl
Synonym 5-amino-4,6-dichloro-2-methylpyrimidine,2-methyl-4,6-dichloro-5-aminopyrimidine,4,6-dichloro-2-methyl-pyrimidin-5-ylamine,5-pyrimidinamine, 4,6-dichloro-2-methyl,4,6-dichloro-2-methyl-pyrimidin-5-amine,4,6-dichloro-2-methylpyrimidin-5-ylamine,pubchem6960,acmc-209j8x,ksc496o2d,fkrxxamahogynt-uhfffaoysa
IUPAC Name 4,6-dichloro-2-methylpyrimidin-5-amine
InChI Key FKRXXAMAHOGYNT-UHFFFAOYSA-N
Molecular Formula C5H5Cl2N3
7

2,4-Dihydroxypyrimidine-5-carboxylic acid, 98%

CAS: 23945-44-0 Molecular Formula: C5H4N2O4 Molecular Weight (g/mol): 156.1 MDL Number: MFCD00149397 InChI Key: ZXYAAVBXHKCJJB-UHFFFAOYSA-N Synonym: 2,4-dihydroxypyrimidine-5-carboxylic acid,uracil 5-carboxylic acid,isoorotic acid,uracil-5-carboxylic acid,5-carboxyuracil,2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid,2,4-dihydroxy-5-pyrimidinecarboxylic acid,5-uracilcarboxylic acid,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo,uracil 5-carboxylate PubChem CID: 90301 ChEBI: CHEBI:17477 IUPAC Name: 2,4-dioxo-1H-pyrimidine-5-carboxylic acid SMILES: C1=C(C(=O)NC(=O)N1)C(=O)O

PubChem CID 90301
CAS 23945-44-0
Molecular Weight (g/mol) 156.1
ChEBI CHEBI:17477
MDL Number MFCD00149397
SMILES C1=C(C(=O)NC(=O)N1)C(=O)O
Synonym 2,4-dihydroxypyrimidine-5-carboxylic acid,uracil 5-carboxylic acid,isoorotic acid,uracil-5-carboxylic acid,5-carboxyuracil,2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid,2,4-dihydroxy-5-pyrimidinecarboxylic acid,5-uracilcarboxylic acid,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo,uracil 5-carboxylate
IUPAC Name 2,4-dioxo-1H-pyrimidine-5-carboxylic acid
InChI Key ZXYAAVBXHKCJJB-UHFFFAOYSA-N
Molecular Formula C5H4N2O4
8

5-Aminouracil, 98%

CAS: 932-52-5 Molecular Formula: C4H5N3O2 Molecular Weight (g/mol): 127.10 MDL Number: MFCD00006025 InChI Key: BISHACNKZIBDFM-UHFFFAOYSA-N Synonym: 5-aminouracil,5-amino-2,4-dihydroxypyrimidine,uracil, 5-amino,2,4 1h,3h-pyrimidinedione, 5-amino,2,4-dihydroxy-5-aminopyrimidine,unii-r2o7eky9g9,r2o7eky9g9,5-aminopyrimidine-2,4-diol,5-amino-1,3-dihydropyrimidine-2,4-dione,wbu PubChem CID: 13611 ChEBI: CHEBI:46348 IUPAC Name: 5-amino-1H-pyrimidine-2,4-dione SMILES: NC1=CNC(=O)NC1=O

PubChem CID 13611
CAS 932-52-5
Molecular Weight (g/mol) 127.10
ChEBI CHEBI:46348
MDL Number MFCD00006025
SMILES NC1=CNC(=O)NC1=O
Synonym 5-aminouracil,5-amino-2,4-dihydroxypyrimidine,uracil, 5-amino,2,4 1h,3h-pyrimidinedione, 5-amino,2,4-dihydroxy-5-aminopyrimidine,unii-r2o7eky9g9,r2o7eky9g9,5-aminopyrimidine-2,4-diol,5-amino-1,3-dihydropyrimidine-2,4-dione,wbu
IUPAC Name 5-amino-1H-pyrimidine-2,4-dione
InChI Key BISHACNKZIBDFM-UHFFFAOYSA-N
Molecular Formula C4H5N3O2
9

Cytosine, 99+%

CAS: 71-30-7 Molecular Formula: C4H5N3O Molecular Weight (g/mol): 111.10 MDL Number: MFCD00006034 InChI Key: OPTASPLRGRRNAP-UHFFFAOYSA-N Synonym: cytosine,4-amino-2-hydroxypyrimidine,cytosinimine,2 1h-pyrimidinone, 4-amino,4-amino-2 1h-pyrimidinone,4-aminopyrimidin-2 1h-one,6-aminopyrimidin-2 1h-one,2 1h-pyrimidinone, 6-amino,cyt,4-amino-2-oxo-1,2-dihydropyrimidine PubChem CID: 597 ChEBI: CHEBI:16040 SMILES: NC1=CC=NC(=O)N1

PubChem CID 597
CAS 71-30-7
Molecular Weight (g/mol) 111.10
ChEBI CHEBI:16040
MDL Number MFCD00006034
SMILES NC1=CC=NC(=O)N1
Synonym cytosine,4-amino-2-hydroxypyrimidine,cytosinimine,2 1h-pyrimidinone, 4-amino,4-amino-2 1h-pyrimidinone,4-aminopyrimidin-2 1h-one,6-aminopyrimidin-2 1h-one,2 1h-pyrimidinone, 6-amino,cyt,4-amino-2-oxo-1,2-dihydropyrimidine
InChI Key OPTASPLRGRRNAP-UHFFFAOYSA-N
Molecular Formula C4H5N3O
10

Pyrazolo[1,5-a]pyrimidine-5-carboxylic acid, 97%

CAS: 1086375-50-9 Molecular Formula: C7H5N3O2 Molecular Weight (g/mol): 163.14 MDL Number: MFCD09414725 InChI Key: SBDWLDBGGVPVAR-UHFFFAOYSA-N Synonym: pyrazolo 1,5-a pyrimidine-5-carboxylic acid,pyrazolo 1?5-a pyrimidine-5-carboxylic acid,8-hydropyrazolo 1,5-a pyrimidine-5-carboxylic acid PubChem CID: 28875802 IUPAC Name: pyrazolo[1,5-a]pyrimidine-5-carboxylic acid SMILES: OC(=O)C1=NC2=CC=NN2C=C1

PubChem CID 28875802
CAS 1086375-50-9
Molecular Weight (g/mol) 163.14
MDL Number MFCD09414725
SMILES OC(=O)C1=NC2=CC=NN2C=C1
Synonym pyrazolo 1,5-a pyrimidine-5-carboxylic acid,pyrazolo 1?5-a pyrimidine-5-carboxylic acid,8-hydropyrazolo 1,5-a pyrimidine-5-carboxylic acid
IUPAC Name pyrazolo[1,5-a]pyrimidine-5-carboxylic acid
InChI Key SBDWLDBGGVPVAR-UHFFFAOYSA-N
Molecular Formula C7H5N3O2
11

4-Amino-2-mercaptopyrimidine, 97%

CAS: 333-49-3 Molecular Formula: C4H5N3S Molecular Weight (g/mol): 127.17 InChI Key: DCPSTSVLRXOYGS-UHFFFAOYSA-N Synonym: 2-thiocytosine,4-amino-2-mercaptopyrimidine,thiocytosine,4-aminopyrimidine-2-thiol,cytosine, thio,cytosine, 2-thio,2 1h-pyrimidinethione, 4-amino,2 1h-pyrimidinone, 4-aminothio,4-amino-2 1h-pyrimidinethione,4-amino-2-thiopyrimidine PubChem CID: 2724245 IUPAC Name: 6-amino-1H-pyrimidine-2-thione SMILES: C1=C(NC(=S)N=C1)N

PubChem CID 2724245
CAS 333-49-3
Molecular Weight (g/mol) 127.17
SMILES C1=C(NC(=S)N=C1)N
Synonym 2-thiocytosine,4-amino-2-mercaptopyrimidine,thiocytosine,4-aminopyrimidine-2-thiol,cytosine, thio,cytosine, 2-thio,2 1h-pyrimidinethione, 4-amino,2 1h-pyrimidinone, 4-aminothio,4-amino-2 1h-pyrimidinethione,4-amino-2-thiopyrimidine
IUPAC Name 6-amino-1H-pyrimidine-2-thione
InChI Key DCPSTSVLRXOYGS-UHFFFAOYSA-N
Molecular Formula C4H5N3S
12
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Pyrimethamine, 98%, Thermo Scientific Chemicals

CAS: 58-14-0 Molecular Formula: C12H13ClN4 Molecular Weight (g/mol): 248.71 MDL Number: MFCD00057350 InChI Key: WKSAUQYGYAYLPV-UHFFFAOYSA-N Synonym: pyrimethamine,chloridine,daraprim,chloridin,diaminopyritamin,5-4-chlorophenyl-6-ethylpyrimidine-2,4-diamine,ethylpyrimidine,pirimetamina,chloridyn,malocide PubChem CID: 4993 ChEBI: CHEBI:8673 IUPAC Name: 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine SMILES: CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1

PubChem CID 4993
CAS 58-14-0
Molecular Weight (g/mol) 248.71
ChEBI CHEBI:8673
MDL Number MFCD00057350
SMILES CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1
Synonym pyrimethamine,chloridine,daraprim,chloridin,diaminopyritamin,5-4-chlorophenyl-6-ethylpyrimidine-2,4-diamine,ethylpyrimidine,pirimetamina,chloridyn,malocide
IUPAC Name 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine
InChI Key WKSAUQYGYAYLPV-UHFFFAOYSA-N
Molecular Formula C12H13ClN4
13

Pyrimidine-2-carboxylic acid, 95%

CAS: 31519-62-7 Molecular Formula: C5H4N2O2 Molecular Weight (g/mol): 124.10 MDL Number: MFCD00856161 InChI Key: ZFCHNZDUMIOWFV-UHFFFAOYSA-N Synonym: 2-pyrimidinecarboxylic acid,2-carboxypyrimidine,pyrimidine carboxylic acid,pyrimidinecarboxylic acid,2-carboxy-1,3-diazine,2-pyrimidinecarboxylic acid 6ci,8ci,9ci,2-pyrimidinecarboxylicacid,2-carboxy pyrimidine,pubchem9603,pyrimidine-carboxylic acid PubChem CID: 12626245 IUPAC Name: pyrimidine-2-carboxylic acid SMILES: OC(=O)C1=NC=CC=N1

PubChem CID 12626245
CAS 31519-62-7
Molecular Weight (g/mol) 124.10
MDL Number MFCD00856161
SMILES OC(=O)C1=NC=CC=N1
Synonym 2-pyrimidinecarboxylic acid,2-carboxypyrimidine,pyrimidine carboxylic acid,pyrimidinecarboxylic acid,2-carboxy-1,3-diazine,2-pyrimidinecarboxylic acid 6ci,8ci,9ci,2-pyrimidinecarboxylicacid,2-carboxy pyrimidine,pubchem9603,pyrimidine-carboxylic acid
IUPAC Name pyrimidine-2-carboxylic acid
InChI Key ZFCHNZDUMIOWFV-UHFFFAOYSA-N
Molecular Formula C5H4N2O2
14

Isocytosine, 99%

CAS: 108-53-2 Molecular Formula: C4H5N3O Molecular Weight (g/mol): 111.10 MDL Number: MFCD00057557 MFCD00023256 InChI Key: XQCZBXHVTFVIFE-UHFFFAOYSA-N Synonym: isocytosine,2-amino-4-hydroxypyrimidine,2-aminopyrimidin-4-ol,2-aminopyrimidin-4 1h-one,2-amino-4-pyrimdinol,2-amino-4-pyrimidone,2-amino-4-oxypyrimidine,2-aminouracil,4-pyrimidinol, 2-amino,4 1h-pyrimidinone, 2-amino PubChem CID: 66950 ChEBI: CHEBI:55502 SMILES: NC1=NC=CC(=O)N1

PubChem CID 66950
CAS 108-53-2
Molecular Weight (g/mol) 111.10
ChEBI CHEBI:55502
MDL Number MFCD00057557 MFCD00023256
SMILES NC1=NC=CC(=O)N1
Synonym isocytosine,2-amino-4-hydroxypyrimidine,2-aminopyrimidin-4-ol,2-aminopyrimidin-4 1h-one,2-amino-4-pyrimdinol,2-amino-4-pyrimidone,2-amino-4-oxypyrimidine,2-aminouracil,4-pyrimidinol, 2-amino,4 1h-pyrimidinone, 2-amino
InChI Key XQCZBXHVTFVIFE-UHFFFAOYSA-N
Molecular Formula C4H5N3O
15

2-chloropyrimidine-5-carboxylic acid, 97%

CAS: 374068-01-6 Molecular Formula: C5H3ClN2O2 Molecular Weight (g/mol): 158.54 MDL Number: MFCD06739036 InChI Key: DUCXUPKLVVSJKA-UHFFFAOYSA-N Synonym: 2-chloro-pyrimidine-5-carboxylic acid,2-chloro-5-carboxypyrimidine,5-carboxy-2-chloropyrimidine,5-pyrimidinecarboxylicacid, 2-chloro,2-chloro-5-pyrimidinecarboxylic acid,5-pyrimidinecarboxylic acid, 2-chloro,2-chloropyrimidine-5-carboxylicacid,acmc-1aig3,2-chloropyrimidine 5-carboxylic acid,2-chloro-5-pyrimidine carboxylic acid PubChem CID: 11094906 IUPAC Name: 2-chloropyrimidine-5-carboxylic acid SMILES: OC(=O)C1=CN=C(Cl)N=C1

PubChem CID 11094906
CAS 374068-01-6
Molecular Weight (g/mol) 158.54
MDL Number MFCD06739036
SMILES OC(=O)C1=CN=C(Cl)N=C1
Synonym 2-chloro-pyrimidine-5-carboxylic acid,2-chloro-5-carboxypyrimidine,5-carboxy-2-chloropyrimidine,5-pyrimidinecarboxylicacid, 2-chloro,2-chloro-5-pyrimidinecarboxylic acid,5-pyrimidinecarboxylic acid, 2-chloro,2-chloropyrimidine-5-carboxylicacid,acmc-1aig3,2-chloropyrimidine 5-carboxylic acid,2-chloro-5-pyrimidine carboxylic acid
IUPAC Name 2-chloropyrimidine-5-carboxylic acid
InChI Key DUCXUPKLVVSJKA-UHFFFAOYSA-N
Molecular Formula C5H3ClN2O2