Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

1 – 15 of 6,126 results

Iminodiacetic acid, 98+%

CAS: 142-73-4 Molecular Formula: C4H7NO4 Molecular Weight (g/mol): 133.103 MDL Number: MFCD00004280 InChI Key: NBZBKCUXIYYUSX-UHFFFAOYSA-N Synonym: iminodiacetic acid,2,2'-iminodiacetic acid,glycine, n-carboxymethyl,aminodiacetic acid,diglycocoll,diglykokoll,diglycin,iminodiethanoic acid,n-carboxymethyl glycine,2,2'-azanediyldiacetic acid PubChem CID: 8897 ChEBI: CHEBI:24786 IUPAC Name: 2-(carboxymethylamino)acetic acid SMILES: C(C(=O)O)NCC(=O)O

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PubChem CID	8897
CAS	142-73-4
Molecular Weight (g/mol)	133.103
ChEBI	CHEBI:24786
MDL Number	MFCD00004280
SMILES	C(C(=O)O)NCC(=O)O
Synonym	iminodiacetic acid,2,2'-iminodiacetic acid,glycine, n-carboxymethyl,aminodiacetic acid,diglycocoll,diglykokoll,diglycin,iminodiethanoic acid,n-carboxymethyl glycine,2,2'-azanediyldiacetic acid
IUPAC Name	2-(carboxymethylamino)acetic acid
InChI Key	NBZBKCUXIYYUSX-UHFFFAOYSA-N
Molecular Formula	C4H7NO4

Thermo Scientific Chemicals Folic acid, 97%, pure

CAS: 59-30-3 Molecular Formula: C₁₉H₁₉N₇O₆ Molecular Weight (g/mol): 441.4 MDL Number: MFCD00079305 InChI Key: OVBPIULPVIDEAO-LBPRGKRZSA-N Synonym: folic acid,folate,pteroylglutamic acid,vitamin m,folacin,folacid,pteglu,vitamin b9,folvite,pteroyl-l-glutamic acid PubChem CID: 6037 ChEBI: CHEBI:27470 IUPAC Name: (2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid SMILES: C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N

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PubChem CID	6037
CAS	59-30-3
Molecular Weight (g/mol)	441.4
ChEBI	CHEBI:27470
MDL Number	MFCD00079305
SMILES	C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N
Synonym	folic acid,folate,pteroylglutamic acid,vitamin m,folacin,folacid,pteglu,vitamin b9,folvite,pteroyl-l-glutamic acid
IUPAC Name	(2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
InChI Key	OVBPIULPVIDEAO-LBPRGKRZSA-N
Molecular Formula	C₁₉H₁₉N₇O₆

Violuric acid monohydrate, 97%

CAS: 26351-19-9 Molecular Formula: C4H5N3O5 Molecular Weight (g/mol): 175.10 MDL Number: MFCD00149401 InChI Key: YHAIHNZKUCGXRI-UHFFFAOYSA-N Synonym: violuric acid monohydrate,5-hydroxyimino pyrimidine-2,4,6 1h,3h,5h-trione hydrate,2,4,5,6 1h,3h-pyrimidinetetrone, 5-oxime, monohydrate,5-hydroxyimino-1,3-diazinane-2,4,6-trione hydrate,alloxan-5-oxime monohydrate,c4nh33o4.h2o,5-isonitrosobarbituric acid monohydrate,5-hydroxyimino pyrimidine-2,4,6 1h,3h,5h-trionehydrate,5-hydroxyimino-1,3-dihydropyrimidine-2,4,6-trione, oxamethane,violuric acid monohydrate, for spectrophotometric det. of co PubChem CID: 21197397 SMILES: O.ON=C1C(=O)NC(=O)NC1=O

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PubChem CID	21197397
CAS	26351-19-9
Molecular Weight (g/mol)	175.10
MDL Number	MFCD00149401
SMILES	O.ON=C1C(=O)NC(=O)NC1=O
Synonym	violuric acid monohydrate,5-hydroxyimino pyrimidine-2,4,6 1h,3h,5h-trione hydrate,2,4,5,6 1h,3h-pyrimidinetetrone, 5-oxime, monohydrate,5-hydroxyimino-1,3-diazinane-2,4,6-trione hydrate,alloxan-5-oxime monohydrate,c4nh33o4.h2o,5-isonitrosobarbituric acid monohydrate,5-hydroxyimino pyrimidine-2,4,6 1h,3h,5h-trionehydrate,5-hydroxyimino-1,3-dihydropyrimidine-2,4,6-trione, oxamethane,violuric acid monohydrate, for spectrophotometric det. of co
InChI Key	YHAIHNZKUCGXRI-UHFFFAOYSA-N
Molecular Formula	C4H5N3O5

2,6-Diaminopimelic acid, 96%

CAS: 583-93-7 Molecular Formula: C7H14N2O4 Molecular Weight (g/mol): 190.199 MDL Number: MFCD00002637 InChI Key: GMKMEZVLHJARHF-UHFFFAOYSA-N Synonym: 2,6-diaminopimelic acid,heptanedioic acid, 2,6-diamino,diaminopimelic acid,dl-2,6-diaminoheptanedioic acid,m-dap,dl-alpha,epsilon-diaminopimelic acid,1,5-diaminoheptanedioic acid,ll-diaminopimelate,d,l-diaminopimelate,ll-a2pm PubChem CID: 865 ChEBI: CHEBI:23673 IUPAC Name: 2,6-diaminoheptanedioic acid SMILES: C(CC(C(=O)O)N)CC(C(=O)O)N

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Specifications

PubChem CID	865
CAS	583-93-7
Molecular Weight (g/mol)	190.199
ChEBI	CHEBI:23673
MDL Number	MFCD00002637
SMILES	C(CC(C(=O)O)N)CC(C(=O)O)N
Synonym	2,6-diaminopimelic acid,heptanedioic acid, 2,6-diamino,diaminopimelic acid,dl-2,6-diaminoheptanedioic acid,m-dap,dl-alpha,epsilon-diaminopimelic acid,1,5-diaminoheptanedioic acid,ll-diaminopimelate,d,l-diaminopimelate,ll-a2pm
IUPAC Name	2,6-diaminoheptanedioic acid
InChI Key	GMKMEZVLHJARHF-UHFFFAOYSA-N
Molecular Formula	C7H14N2O4

Nitrilotriacetic acid, 99%

CAS: 139-13-9 Molecular Formula: C6H9NO6 Molecular Weight (g/mol): 191.14 MDL Number: MFCD00004287 InChI Key: MGFYIUFZLHCRTH-UHFFFAOYSA-N Synonym: nitrilotriacetic acid,2,2',2-nitrilotriacetic acid,triglycollamic acid,aminotriacetic acid,complexon i,trilon a,n,n-bis carboxymethyl glycine,nitrilotriacetate,komplexon i,titriplex i PubChem CID: 8758 ChEBI: CHEBI:44557 IUPAC Name: 2-[bis(carboxymethyl)amino]acetic acid SMILES: OC(=O)CN(CC(O)=O)CC(O)=O

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Specifications

PubChem CID	8758
CAS	139-13-9
Molecular Weight (g/mol)	191.14
ChEBI	CHEBI:44557
MDL Number	MFCD00004287
SMILES	OC(=O)CN(CC(O)=O)CC(O)=O
Synonym	nitrilotriacetic acid,2,2',2-nitrilotriacetic acid,triglycollamic acid,aminotriacetic acid,complexon i,trilon a,n,n-bis carboxymethyl glycine,nitrilotriacetate,komplexon i,titriplex i
IUPAC Name	2-[bis(carboxymethyl)amino]acetic acid
InChI Key	MGFYIUFZLHCRTH-UHFFFAOYSA-N
Molecular Formula	C6H9NO6

PubChem CID	8758
CAS	139-13-9
Molecular Weight (g/mol)	191.14
ChEBI	CHEBI:44557
MDL Number	MFCD00004287
SMILES	OC(=O)CN(CC(O)=O)CC(O)=O
Synonym	nitrilotriacetic acid,2,2',2-nitrilotriacetic acid,triglycollamic acid,aminotriacetic acid,complexon i,trilon a,n,n-bis carboxymethyl glycine,nitrilotriacetate,komplexon i,titriplex i
IUPAC Name	2-[bis(carboxymethyl)amino]acetic acid
InChI Key	MGFYIUFZLHCRTH-UHFFFAOYSA-N
Molecular Formula	C6H9NO6

Alginic acid sodium salt, high viscosity

CAS: 9005-38-3 Molecular Formula: (C6H7O7)A(C6H7O7)BNa MDL Number: MFCD00081310 Synonym: Algin; Sodium alginate

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Specifications

CAS	9005-38-3
MDL Number	MFCD00081310
Synonym	Algin; Sodium alginate
Molecular Formula	(C6H7O7)A(C6H7O7)BNa

Kojic acid, 99%

CAS: 501-30-4 Molecular Formula: C6H6O4 Molecular Weight (g/mol): 142.11 MDL Number: MFCD00006580 InChI Key: BEJNERDRQOWKJM-UHFFFAOYSA-N Synonym: kojic acid,5-hydroxy-2-hydroxymethyl-4h-pyran-4-one,5-hydroxy-2-hydroxymethyl-4-pyrone,4h-pyran-4-one, 5-hydroxy-2-hydroxymethyl,5-hydroxy-2-hydroxymethyl pyran-4-one,acido kojico,2-hydroxymethyl-5-hydroxy-gamma-pyrone,2-hydroxymethyl-5-hydroxy-4h-pyran-4-one,unii-6k23f1tt52 PubChem CID: 3840 ChEBI: CHEBI:43572 IUPAC Name: 5-hydroxy-2-(hydroxymethyl)pyran-4-one SMILES: OCC1=CC(=O)C(O)=CO1

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Specifications

PubChem CID	3840
CAS	501-30-4
Molecular Weight (g/mol)	142.11
ChEBI	CHEBI:43572
MDL Number	MFCD00006580
SMILES	OCC1=CC(=O)C(O)=CO1
Synonym	kojic acid,5-hydroxy-2-hydroxymethyl-4h-pyran-4-one,5-hydroxy-2-hydroxymethyl-4-pyrone,4h-pyran-4-one, 5-hydroxy-2-hydroxymethyl,5-hydroxy-2-hydroxymethyl pyran-4-one,acido kojico,2-hydroxymethyl-5-hydroxy-gamma-pyrone,2-hydroxymethyl-5-hydroxy-4h-pyran-4-one,unii-6k23f1tt52
IUPAC Name	5-hydroxy-2-(hydroxymethyl)pyran-4-one
InChI Key	BEJNERDRQOWKJM-UHFFFAOYSA-N
Molecular Formula	C6H6O4

Naphthenic acids, pract.

CAS: 1338-24-5 MDL Number: MFCD00147696

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Specifications

CAS	1338-24-5
MDL Number	MFCD00147696

L-Dehydroascorbic acid, 96%

CAS: 490-83-5 Molecular Formula: C6H6O6 Molecular Weight (g/mol): 174.11 InChI Key: SBJKKFFYIZUCET-UHFFFAOYNA-N IUPAC Name: 5-(1,2-dihydroxyethyl)oxolane-2,3,4-trione SMILES: OCC(O)C1OC(=O)C(=O)C1=O

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Specifications

CAS	490-83-5
Molecular Weight (g/mol)	174.11
SMILES	OCC(O)C1OC(=O)C(=O)C1=O
IUPAC Name	5-(1,2-dihydroxyethyl)oxolane-2,3,4-trione
InChI Key	SBJKKFFYIZUCET-UHFFFAOYNA-N
Molecular Formula	C6H6O6

Hydriodic acid, for analysis, 57 wt.% aqueous solution, distilled, stabilized

CAS: 10034-85-2 Molecular Formula: HI Molecular Weight (g/mol): 127.91 MDL Number: MFCD00011347 InChI Key: XMBWDFGMSWQBCA-UHFFFAOYSA-N IUPAC Name: hydrogen iodide SMILES: I

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CAS	10034-85-2
Molecular Weight (g/mol)	127.91
MDL Number	MFCD00011347
SMILES	I
IUPAC Name	hydrogen iodide
InChI Key	XMBWDFGMSWQBCA-UHFFFAOYSA-N
Molecular Formula	HI

(+)-Abscisic acid, 98%

CAS: 21293-29-8 Molecular Formula: C15H20O4 Molecular Weight (g/mol): 264.32 MDL Number: MFCD00066545,MFCD00066545,MFCD00075619 InChI Key: JLIDBLDQVAYHNE-YKALOCIXSA-N IUPAC Name: (2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid SMILES: C\C(\C=C\[C@@]1(O)C(C)=CC(=O)CC1(C)C)=C\C(O)=O

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Specifications

CAS	21293-29-8
Molecular Weight (g/mol)	264.32
MDL Number	MFCD00066545,MFCD00066545,MFCD00075619
SMILES	C\C(\C=C\[C@@]1(O)C(C)=CC(=O)CC1(C)C)=C\C(O)=O
IUPAC Name	(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid
InChI Key	JLIDBLDQVAYHNE-YKALOCIXSA-N
Molecular Formula	C15H20O4

Azadibenzocyclooctyne acid

CAS: 1425485-72-8 Molecular Formula: C21H19NO3 Molecular Weight (g/mol): 333.39 MDL Number: MFCD22380737 InChI Key: NIRLBCOFKPVQLM-UHFFFAOYSA-N Synonym: dbco-c6-acid,azadibenzocyclooctyne acid,dibenzocyclooctyne-acid, storage temp.:-20c,6-11,12-didehydro-5,6-dihydrodibenzo b,f azocine-5-yl-6-oxohexanoic acid PubChem CID: 77078156

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Specifications

PubChem CID	77078156
CAS	1425485-72-8
Molecular Weight (g/mol)	333.39
MDL Number	MFCD22380737
Synonym	dbco-c6-acid,azadibenzocyclooctyne acid,dibenzocyclooctyne-acid, storage temp.:-20c,6-11,12-didehydro-5,6-dihydrodibenzo b,f azocine-5-yl-6-oxohexanoic acid
InChI Key	NIRLBCOFKPVQLM-UHFFFAOYSA-N
Molecular Formula	C21H19NO3

Phenylphosphinic acid, 98%

CAS: 1779-48-2 Molecular Formula: C6H7O2P Molecular Weight (g/mol): 142.09 MDL Number: MFCD00002131 InChI Key: MLCHBQKMVKNBOV-UHFFFAOYSA-N Synonym: phenylphosphinic acid,benzenephosphinic acid,phosphinic acid, phenyl,benzenephosphonous acid,phenyl phosphinic acid,mlchbqkmvknbov-uhfffaoysa-n,benzolphosphonigs,aure,benzene phosphinic acid,hydroxyphenylphosphineoxide,acmc-1bt5t PubChem CID: 6327116 IUPAC Name: hydroxy-oxo-phenylphosphanium SMILES: OP(=O)C1=CC=CC=C1

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Specifications

PubChem CID	6327116
CAS	1779-48-2
Molecular Weight (g/mol)	142.09
MDL Number	MFCD00002131
SMILES	OP(=O)C1=CC=CC=C1
Synonym	phenylphosphinic acid,benzenephosphinic acid,phosphinic acid, phenyl,benzenephosphonous acid,phenyl phosphinic acid,mlchbqkmvknbov-uhfffaoysa-n,benzolphosphonigs,aure,benzene phosphinic acid,hydroxyphenylphosphineoxide,acmc-1bt5t
IUPAC Name	hydroxy-oxo-phenylphosphanium
InChI Key	MLCHBQKMVKNBOV-UHFFFAOYSA-N
Molecular Formula	C6H7O2P

Phenylacetic acid, 98.5%

CAS: 103-82-2 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 InChI Key: WLJVXDMOQOGPHL-UHFFFAOYSA-N IUPAC Name: 2-phenylacetic acid SMILES: OC(=O)CC1=CC=CC=C1

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CAS	103-82-2
Molecular Weight (g/mol)	136.15
SMILES	OC(=O)CC1=CC=CC=C1
IUPAC Name	2-phenylacetic acid
InChI Key	WLJVXDMOQOGPHL-UHFFFAOYSA-N
Molecular Formula	C8H8O2

Unclassified Organic Compounds

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