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Organooxygen compounds

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1 – 15 of 260 results
1

Riboflavin, 98%

CAS: 83-88-5 Molecular Formula: C17H20N4O6 Molecular Weight (g/mol): 376.37 MDL Number: MFCD00005022 InChI Key: AUNGANRZJHBGPY-QTZZOOGMNA-N Synonym: riboflavin,vitamin b2,lactoflavin,riboflavine,vitamin g,lactoflavine,--riboflavin,beflavin,beflavine,flavaxin PubChem CID: 71310809 IUPAC Name: 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione SMILES: CC1=C(C)C=C2N(C[C@H](O)[C@H](O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=NC2=C1

EDGE
PubChem CID 71310809
CAS 83-88-5
Molecular Weight (g/mol) 376.37
MDL Number MFCD00005022
SMILES CC1=C(C)C=C2N(C[C@H](O)[C@H](O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=NC2=C1
Synonym riboflavin,vitamin b2,lactoflavin,riboflavine,vitamin g,lactoflavine,--riboflavin,beflavin,beflavine,flavaxin
IUPAC Name 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione
InChI Key AUNGANRZJHBGPY-QTZZOOGMNA-N
Molecular Formula C17H20N4O6
2

Thermo Scientific Chemicals myo-Inositol, 98+%

CAS: 87-89-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00077932 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N Synonym: scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol PubChem CID: 892 ChEBI: CHEBI:24848 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: C1(C(C(C(C(C1O)O)O)O)O)O

EDGE
PubChem CID 892
CAS 87-89-8
Molecular Weight (g/mol) 180.156
ChEBI CHEBI:24848
MDL Number MFCD00077932
SMILES C1(C(C(C(C(C1O)O)O)O)O)O
Synonym scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol
IUPAC Name cyclohexane-1,2,3,4,5,6-hexol
InChI Key CDAISMWEOUEBRE-UHFFFAOYSA-N
Molecular Formula C6H12O6
3

Glyoxal, 40% w/w aq. soln.

CAS: 107-22-2 Molecular Formula: C2H2O2 Molecular Weight (g/mol): 58.036 MDL Number: MFCD00006957 InChI Key: LEQAOMBKQFMDFZ-UHFFFAOYSA-N Synonym: glyoxal,ethanedial,oxalaldehyde,1,2-ethanedione,glyoxylaldehyde,biformal,biformyl,diformal,diformyl,aerotex glyoxal 40 PubChem CID: 7860 ChEBI: CHEBI:34779 IUPAC Name: oxaldehyde SMILES: C(=O)C=O

EDGE
PubChem CID 7860
CAS 107-22-2
Molecular Weight (g/mol) 58.036
ChEBI CHEBI:34779
MDL Number MFCD00006957
SMILES C(=O)C=O
Synonym glyoxal,ethanedial,oxalaldehyde,1,2-ethanedione,glyoxylaldehyde,biformal,biformyl,diformal,diformyl,aerotex glyoxal 40
IUPAC Name oxaldehyde
InChI Key LEQAOMBKQFMDFZ-UHFFFAOYSA-N
Molecular Formula C2H2O2
4

Phorbol 12-myristate 13-acetate, 95%

CAS: 16561-29-8 Molecular Formula: C36H56O8 Molecular Weight (g/mol): 616.84 MDL Number: MFCD00036736 InChI Key: PHEDXBVPIONUQT-RGYGYFBISA-N Synonym: phorbol 12-myristate 13-acetate,phorbol ester,12-o-tetradecanoylphorbol-13-acetate,12-o-tetradecanoylphorbol 13-acetate,factor a1,tetradecanoylphorbol acetate,12-tetradecanoylphorbol 13-acetate,factor a1 croton oil,phorbol 13-acetate 12-myristate,phorbol-12-myristate-13-acetate PubChem CID: 27924 ChEBI: CHEBI:37537 IUPAC Name: (1S,2S,6R,10S,11R,13S,14R,15R)-13-(acetyloxy)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxotetracyclo[8.5.0.0²,⁶.0¹¹,¹³]pentadeca-3,8-dien-14-yl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)O[C@@H]1[C@@H](C)[C@]2(O)[C@@H]3C=C(C)C(=O)[C@@]3(O)CC(CO)=C[C@H]2[C@@H]2C(C)(C)[C@]12OC(C)=O

EDGE
PubChem CID 27924
CAS 16561-29-8
Molecular Weight (g/mol) 616.84
ChEBI CHEBI:37537
MDL Number MFCD00036736
SMILES CCCCCCCCCCCCCC(=O)O[C@@H]1[C@@H](C)[C@]2(O)[C@@H]3C=C(C)C(=O)[C@@]3(O)CC(CO)=C[C@H]2[C@@H]2C(C)(C)[C@]12OC(C)=O
Synonym phorbol 12-myristate 13-acetate,phorbol ester,12-o-tetradecanoylphorbol-13-acetate,12-o-tetradecanoylphorbol 13-acetate,factor a1,tetradecanoylphorbol acetate,12-tetradecanoylphorbol 13-acetate,factor a1 croton oil,phorbol 13-acetate 12-myristate,phorbol-12-myristate-13-acetate
IUPAC Name (1S,2S,6R,10S,11R,13S,14R,15R)-13-(acetyloxy)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxotetracyclo[8.5.0.0²,⁶.0¹¹,¹³]pentadeca-3,8-dien-14-yl tetradecanoate
InChI Key PHEDXBVPIONUQT-RGYGYFBISA-N
Molecular Formula C36H56O8
5

2-Ketoglutaric acid, 98%

CAS: 328-50-7 Molecular Formula: C5H6O5 Molecular Weight (g/mol): 146.098 MDL Number: MFCD00004165 InChI Key: KPGXRSRHYNQIFN-UHFFFAOYSA-N Synonym: 2-ketoglutaric acid,alpha-ketoglutaric acid,2-oxoglutaric acid,2-oxoglutarate,oxoglutaric acid,alpha-ketoglutarate,2-ketoglutarate,alphaketoglutaric acid,alpha-oxoglutaric acid,2-oxo-1,5-pentanedioic acid PubChem CID: 51 ChEBI: CHEBI:30915 IUPAC Name: 2-oxopentanedioic acid SMILES: C(CC(=O)O)C(=O)C(=O)O

PubChem CID 51
CAS 328-50-7
Molecular Weight (g/mol) 146.098
ChEBI CHEBI:30915
MDL Number MFCD00004165
SMILES C(CC(=O)O)C(=O)C(=O)O
Synonym 2-ketoglutaric acid,alpha-ketoglutaric acid,2-oxoglutaric acid,2-oxoglutarate,oxoglutaric acid,alpha-ketoglutarate,2-ketoglutarate,alphaketoglutaric acid,alpha-oxoglutaric acid,2-oxo-1,5-pentanedioic acid
IUPAC Name 2-oxopentanedioic acid
InChI Key KPGXRSRHYNQIFN-UHFFFAOYSA-N
Molecular Formula C5H6O5
6

D-(-)-Quinic acid, 98%

CAS: 77-95-2 Molecular Formula: C7H12O6 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00003864 InChI Key: AAWZDTNXLSGCEK-UHFFFAOYNA-N Synonym: quinic acid,d---quinic acid,--quinic acid,chinic acid,kinic acid,chinasaure,quinate,l-quinic acid,d-quinic acid,unii-058c04bgyi PubChem CID: 6508 IUPAC Name: (3R,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid SMILES: OC1CC(O)(CC(O)C1O)C(O)=O

PubChem CID 6508
CAS 77-95-2
Molecular Weight (g/mol) 192.17
MDL Number MFCD00003864
SMILES OC1CC(O)(CC(O)C1O)C(O)=O
Synonym quinic acid,d---quinic acid,--quinic acid,chinic acid,kinic acid,chinasaure,quinate,l-quinic acid,d-quinic acid,unii-058c04bgyi
IUPAC Name (3R,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid
InChI Key AAWZDTNXLSGCEK-UHFFFAOYNA-N
Molecular Formula C7H12O6
7

1,4-Butanediol, 99%

CAS: 110-63-4 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.12 MDL Number: MFCD00002968 InChI Key: WERYXYBDKMZEQL-UHFFFAOYSA-N Synonym: 1,4-butanediol,1,4-butylene glycol,tetramethylene glycol,1,4-dihydroxybutane,1,4-tetramethylene glycol,tetramethylene 1,4-diol,sucol b,diol 14b,agrisynth b1d,unii-7xoo2le6g3 PubChem CID: 8064 ChEBI: CHEBI:41189 IUPAC Name: butane-1,4-diol SMILES: OCCCCO

PubChem CID 8064
CAS 110-63-4
Molecular Weight (g/mol) 90.12
ChEBI CHEBI:41189
MDL Number MFCD00002968
SMILES OCCCCO
Synonym 1,4-butanediol,1,4-butylene glycol,tetramethylene glycol,1,4-dihydroxybutane,1,4-tetramethylene glycol,tetramethylene 1,4-diol,sucol b,diol 14b,agrisynth b1d,unii-7xoo2le6g3
IUPAC Name butane-1,4-diol
InChI Key WERYXYBDKMZEQL-UHFFFAOYSA-N
Molecular Formula C4H10O2
8

2,5-Dimethoxy-4-methylbenzaldehyde, 97%

CAS: 4925-88-6 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD02253192 InChI Key: LRSRTWLEJBIAIT-UHFFFAOYSA-N Synonym: 4-methyl-2,5-dimethoxybenzaldehyde,unii-238b3l4auk,2,5-dimethoxy-4-methyl-benzaldehyde,benzaldehyde, 2,5-dimethoxy-4-methyl,2,5-dimethoxy-p-tolualdehyde,p-tolualdehyde, 2,5-dimethoxy,who-dd,2,5-dimethoxy-4-methylbenzaldehyde;,2,5-dimethoxy-4-methyl-benzaldehyde;,# PubChem CID: 602019 IUPAC Name: 2,5-dimethoxy-4-methylbenzaldehyde SMILES: COC1=CC(C)=C(OC)C=C1C=O

PubChem CID 602019
CAS 4925-88-6
Molecular Weight (g/mol) 180.20
MDL Number MFCD02253192
SMILES COC1=CC(C)=C(OC)C=C1C=O
Synonym 4-methyl-2,5-dimethoxybenzaldehyde,unii-238b3l4auk,2,5-dimethoxy-4-methyl-benzaldehyde,benzaldehyde, 2,5-dimethoxy-4-methyl,2,5-dimethoxy-p-tolualdehyde,p-tolualdehyde, 2,5-dimethoxy,who-dd,2,5-dimethoxy-4-methylbenzaldehyde;,2,5-dimethoxy-4-methyl-benzaldehyde;,#
IUPAC Name 2,5-dimethoxy-4-methylbenzaldehyde
InChI Key LRSRTWLEJBIAIT-UHFFFAOYSA-N
Molecular Formula C10H12O3
9

4'-Hydroxy-3'-methoxyacetophenone, 98%

CAS: 498-02-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00008747 InChI Key: DFYRUELUNQRZTB-UHFFFAOYSA-N Synonym: acetovanillone,apocynin,4'-hydroxy-3'-methoxyacetophenone,1-4-hydroxy-3-methoxyphenyl ethanone,acetoguaiacone,acetoguaiacon,apocynine,4-acetyl-2-methoxyphenol,acetovanilone,acetovanyllon PubChem CID: 2214 ChEBI: CHEBI:2781 IUPAC Name: 1-(4-hydroxy-3-methoxyphenyl)ethanone SMILES: COC1=CC(=CC=C1O)C(C)=O

PubChem CID 2214
CAS 498-02-2
Molecular Weight (g/mol) 166.18
ChEBI CHEBI:2781
MDL Number MFCD00008747
SMILES COC1=CC(=CC=C1O)C(C)=O
Synonym acetovanillone,apocynin,4'-hydroxy-3'-methoxyacetophenone,1-4-hydroxy-3-methoxyphenyl ethanone,acetoguaiacone,acetoguaiacon,apocynine,4-acetyl-2-methoxyphenol,acetovanilone,acetovanyllon
IUPAC Name 1-(4-hydroxy-3-methoxyphenyl)ethanone
InChI Key DFYRUELUNQRZTB-UHFFFAOYSA-N
Molecular Formula C9H10O3
10

Bromopyruvic acid, 97%

CAS: 1113-59-3 Molecular Formula: C3H3BrO3 Molecular Weight (g/mol): 166.958 MDL Number: MFCD00002587 InChI Key: PRRZDZJYSJLDBS-UHFFFAOYSA-N Synonym: 3-bromopyruvic acid,bromopyruvic acid,bromopyruvate,3-bromopyruvate,3-bromo-2-oxopropionic acid,bromopyruvicacid,pyruvic acid, bromo,propanoic acid, 3-bromo-2-oxo,unii-63jmv04grk,.beta.-bromopyruvic acid PubChem CID: 70684 IUPAC Name: 3-bromo-2-oxopropanoic acid SMILES: C(C(=O)C(=O)O)Br

PubChem CID 70684
CAS 1113-59-3
Molecular Weight (g/mol) 166.958
MDL Number MFCD00002587
SMILES C(C(=O)C(=O)O)Br
Synonym 3-bromopyruvic acid,bromopyruvic acid,bromopyruvate,3-bromopyruvate,3-bromo-2-oxopropionic acid,bromopyruvicacid,pyruvic acid, bromo,propanoic acid, 3-bromo-2-oxo,unii-63jmv04grk,.beta.-bromopyruvic acid
IUPAC Name 3-bromo-2-oxopropanoic acid
InChI Key PRRZDZJYSJLDBS-UHFFFAOYSA-N
Molecular Formula C3H3BrO3
11

Pyrrole-2-carboxaldehyde, 99%

CAS: 1003-29-8 Molecular Formula: C5H5NO Molecular Weight (g/mol): 95.101 MDL Number: MFCD00005217 InChI Key: ZSKGQVFRTSEPJT-UHFFFAOYSA-N Synonym: pyrrole-2-carboxaldehyde,2-formylpyrrole,1h-pyrrole-2-carboxaldehyde,pyrrole-2-aldehyde,2-pyrrolecarboxaldehyde,pyrrole-2-carbaldehyde,2-pyrrolecarbaldehyde,2-pyrrolylcarboxaldehyde,2-pyrrolaldehyde,alpha-pyrrolaldehyde PubChem CID: 13854 ChEBI: CHEBI:59978 IUPAC Name: 1H-pyrrole-2-carbaldehyde SMILES: C1=CNC(=C1)C=O

PubChem CID 13854
CAS 1003-29-8
Molecular Weight (g/mol) 95.101
ChEBI CHEBI:59978
MDL Number MFCD00005217
SMILES C1=CNC(=C1)C=O
Synonym pyrrole-2-carboxaldehyde,2-formylpyrrole,1h-pyrrole-2-carboxaldehyde,pyrrole-2-aldehyde,2-pyrrolecarboxaldehyde,pyrrole-2-carbaldehyde,2-pyrrolecarbaldehyde,2-pyrrolylcarboxaldehyde,2-pyrrolaldehyde,alpha-pyrrolaldehyde
IUPAC Name 1H-pyrrole-2-carbaldehyde
InChI Key ZSKGQVFRTSEPJT-UHFFFAOYSA-N
Molecular Formula C5H5NO
12

2,4'-Dibromoacetophenone, 98+%

CAS: 99-73-0 Molecular Formula: C8H6Br2O Molecular Weight (g/mol): 277.943 MDL Number: MFCD00000200 InChI Key: FKJSFKCZZIXQIP-UHFFFAOYSA-N Synonym: 2,4'-dibromoacetophenone,2-bromo-1-4-bromophenyl ethanone,4-bromophenacyl bromide,p-bromophenacyl bromide,ethanone, 2-bromo-1-4-bromophenyl,4'-bromophenacyl bromide,p-bromophenacyl-8,alpha,p-dibromoacetophenone,alpha,4-dibromoacetophenone,4-bromo bromoacetyl benzene PubChem CID: 7454 IUPAC Name: 2-bromo-1-(4-bromophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CBr)Br

PubChem CID 7454
CAS 99-73-0
Molecular Weight (g/mol) 277.943
MDL Number MFCD00000200
SMILES C1=CC(=CC=C1C(=O)CBr)Br
Synonym 2,4'-dibromoacetophenone,2-bromo-1-4-bromophenyl ethanone,4-bromophenacyl bromide,p-bromophenacyl bromide,ethanone, 2-bromo-1-4-bromophenyl,4'-bromophenacyl bromide,p-bromophenacyl-8,alpha,p-dibromoacetophenone,alpha,4-dibromoacetophenone,4-bromo bromoacetyl benzene
IUPAC Name 2-bromo-1-(4-bromophenyl)ethanone
InChI Key FKJSFKCZZIXQIP-UHFFFAOYSA-N
Molecular Formula C8H6Br2O
13

Glyoxylic acid monohydrate, 97%

CAS: 563-96-2 Molecular Formula: C2H4O4 Molecular Weight (g/mol): 92.05 MDL Number: MFCD00149497 InChI Key: MOOYVEVEDVVKGD-UHFFFAOYSA-N Synonym: glyoxylic acid monohydrate,glyoxylic acid hydrate,2-oxoacetic acid hydrate,oxaldehydic acid hydrate,glyoxalic acid monohydrate,glyoxalate, glyoxylate hydrate,glyoxalic acid hydrate,oxoacetate monohydrate,glyoxylic acid-hydrate,oxoacetic acid hydrate PubChem CID: 15620607 IUPAC Name: oxaldehydic acid;hydrate SMILES: C(=O)C(=O)O.O

PubChem CID 15620607
CAS 563-96-2
Molecular Weight (g/mol) 92.05
MDL Number MFCD00149497
SMILES C(=O)C(=O)O.O
Synonym glyoxylic acid monohydrate,glyoxylic acid hydrate,2-oxoacetic acid hydrate,oxaldehydic acid hydrate,glyoxalic acid monohydrate,glyoxalate, glyoxylate hydrate,glyoxalic acid hydrate,oxoacetate monohydrate,glyoxylic acid-hydrate,oxoacetic acid hydrate
IUPAC Name oxaldehydic acid;hydrate
InChI Key MOOYVEVEDVVKGD-UHFFFAOYSA-N
Molecular Formula C2H4O4
14

Diethylene glycol dibutyl ether, 99+%

CAS: 112-73-2 Molecular Formula: C12H26O3 Molecular Weight (g/mol): 218.337 MDL Number: MFCD00009459 InChI Key: KZVBBTZJMSWGTK-UHFFFAOYSA-N Synonym: diethylene glycol dibutyl ether,bis 2-butoxyethyl ether,dibutyl carbitol,butyl diglyme,1-2-2-butoxyethoxy ethoxy butane,5,8,11-trioxapentadecane,ether, bis butoxyethyl,2,2'-dibutoxyethyl ether,ether, bis 2-butoxyethyl PubChem CID: 8210 IUPAC Name: 1-[2-(2-butoxyethoxy)ethoxy]butane SMILES: CCCCOCCOCCOCCCC

PubChem CID 8210
CAS 112-73-2
Molecular Weight (g/mol) 218.337
MDL Number MFCD00009459
SMILES CCCCOCCOCCOCCCC
Synonym diethylene glycol dibutyl ether,bis 2-butoxyethyl ether,dibutyl carbitol,butyl diglyme,1-2-2-butoxyethoxy ethoxy butane,5,8,11-trioxapentadecane,ether, bis butoxyethyl,2,2'-dibutoxyethyl ether,ether, bis 2-butoxyethyl
IUPAC Name 1-[2-(2-butoxyethoxy)ethoxy]butane
InChI Key KZVBBTZJMSWGTK-UHFFFAOYSA-N
Molecular Formula C12H26O3
15

Thiophene-2-carboxaldehyde, 98+%

CAS: 98-03-3 Molecular Formula: C5H4OS Molecular Weight (g/mol): 112.15 MDL Number: MFCD00005429 InChI Key: CNUDBTRUORMMPA-UHFFFAOYSA-N Synonym: 2-thiophenecarboxaldehyde,2-thenaldehyde,thiophene-2-aldehyde,2-formylthiophene,2-thienylaldehyde,2-thiophenealdehyde,thiophene-2-carboxaldehyde,2-thienylcarboxaldehyde,2-thienaldehyde,alpha-formylthiophene PubChem CID: 7364 ChEBI: CHEBI:87301 IUPAC Name: thiophene-2-carbaldehyde SMILES: O=CC1=CC=CS1

PubChem CID 7364
CAS 98-03-3
Molecular Weight (g/mol) 112.15
ChEBI CHEBI:87301
MDL Number MFCD00005429
SMILES O=CC1=CC=CS1
Synonym 2-thiophenecarboxaldehyde,2-thenaldehyde,thiophene-2-aldehyde,2-formylthiophene,2-thienylaldehyde,2-thiophenealdehyde,thiophene-2-carboxaldehyde,2-thienylcarboxaldehyde,2-thienaldehyde,alpha-formylthiophene
IUPAC Name thiophene-2-carbaldehyde
InChI Key CNUDBTRUORMMPA-UHFFFAOYSA-N
Molecular Formula C5H4OS