Carboxylic acids and derivatives
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Malonamamidine hydrochloride, 98+%
CAS: 34570-17-7 Molecular Formula: C3H7ClN3O Molecular Weight (g/mol): 136.56 MDL Number: MFCD00013007 InChI Key: MDSJPVJGEXMXIC-UHFFFAOYSA-N Synonym: malonamamidine hydrochloride,3-amino-3-iminopropanamide hydrochloride,amidinomalonamide hydrochloride,2-carbamimidoylacetamide hydrochloride,propanamide, 3-amino-3-imino-, monohydrochloride,amidinomalonamide hcl,amindinomalonamide,malonamideamidine hydrochloride,tos-bb-1115 PubChem CID: 3084595 IUPAC Name: 3-amino-3-iminopropanamide;hydrochloride SMILES: [Cl].NC(=N)CC(N)=O
| PubChem CID | 3084595 |
|---|---|
| CAS | 34570-17-7 |
| Molecular Weight (g/mol) | 136.56 |
| MDL Number | MFCD00013007 |
| SMILES | [Cl].NC(=N)CC(N)=O |
| Synonym | malonamamidine hydrochloride,3-amino-3-iminopropanamide hydrochloride,amidinomalonamide hydrochloride,2-carbamimidoylacetamide hydrochloride,propanamide, 3-amino-3-imino-, monohydrochloride,amidinomalonamide hcl,amindinomalonamide,malonamideamidine hydrochloride,tos-bb-1115 |
| IUPAC Name | 3-amino-3-iminopropanamide;hydrochloride |
| InChI Key | MDSJPVJGEXMXIC-UHFFFAOYSA-N |
| Molecular Formula | C3H7ClN3O |
1H-Indazole-3-carboxylic acid, 98%
CAS: 4498-67-3 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00211066 InChI Key: BHXVYTQDWMQVBI-UHFFFAOYSA-N Synonym: indazole-3-carboxylic acid,3-carboxyindazole,3-indazolecarboxylic acid,indazole-3-carboxylicacid,1h-indazol-3-carbonic acid,2h-indazole-3-carboxylic acid,3-carboxy-1h-indazole,1h-indazole-3-carbonic acid,1-h-indazole-3-carboxylic acid,benzopyrazole-3-carboxylic acid PubChem CID: 78250 IUPAC Name: 1H-indazole-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=NN2)C(=O)O
| PubChem CID | 78250 |
|---|---|
| CAS | 4498-67-3 |
| Molecular Weight (g/mol) | 162.148 |
| MDL Number | MFCD00211066 |
| SMILES | C1=CC=C2C(=C1)C(=NN2)C(=O)O |
| Synonym | indazole-3-carboxylic acid,3-carboxyindazole,3-indazolecarboxylic acid,indazole-3-carboxylicacid,1h-indazol-3-carbonic acid,2h-indazole-3-carboxylic acid,3-carboxy-1h-indazole,1h-indazole-3-carbonic acid,1-h-indazole-3-carboxylic acid,benzopyrazole-3-carboxylic acid |
| IUPAC Name | 1H-indazole-3-carboxylic acid |
| InChI Key | BHXVYTQDWMQVBI-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O2 |
A-803467, 98%, Thermo Scientific Chemicals
CAS: 944261-79-4 Molecular Formula: C19H16ClNO4 Molecular Weight (g/mol): 357.79 MDL Number: MFCD10574689 InChI Key: VHKBTPQDHDSBSP-UHFFFAOYSA-N PubChem CID: 16038374 IUPAC Name: 5-(4-chlorophenyl)-N-(3,5-dimethoxyphenyl)furan-2-carboxamide SMILES: COC1=CC(OC)=CC(NC(=O)C2=CC=C(O2)C2=CC=C(Cl)C=C2)=C1
| PubChem CID | 16038374 |
|---|---|
| CAS | 944261-79-4 |
| Molecular Weight (g/mol) | 357.79 |
| MDL Number | MFCD10574689 |
| SMILES | COC1=CC(OC)=CC(NC(=O)C2=CC=C(O2)C2=CC=C(Cl)C=C2)=C1 |
| IUPAC Name | 5-(4-chlorophenyl)-N-(3,5-dimethoxyphenyl)furan-2-carboxamide |
| InChI Key | VHKBTPQDHDSBSP-UHFFFAOYSA-N |
| Molecular Formula | C19H16ClNO4 |
Ethyl cyanoformate, 99%
CAS: 623-49-4 Molecular Formula: C4H5NO2 Molecular Weight (g/mol): 99.09 MDL Number: MFCD00001836 InChI Key: MSMGXWFHBSCQFB-UHFFFAOYSA-N Synonym: carbonocyanidic acid, ethyl ester,ethyl carbonocyanidate,2-ethoxy-2-oxoacetonitrile,cyanoformic acid ethyl ester,ethyl carbonocyanidoate,formic acid, cyano-, ethyl ester,cyanocarbonyloxyethane,ethylcyanidocarbonat,ethyl cyanoformate,ethyl cyanocarbonate PubChem CID: 69336 IUPAC Name: ethyl cyanoformate SMILES: CCOC(=O)C#N
| PubChem CID | 69336 |
|---|---|
| CAS | 623-49-4 |
| Molecular Weight (g/mol) | 99.09 |
| MDL Number | MFCD00001836 |
| SMILES | CCOC(=O)C#N |
| Synonym | carbonocyanidic acid, ethyl ester,ethyl carbonocyanidate,2-ethoxy-2-oxoacetonitrile,cyanoformic acid ethyl ester,ethyl carbonocyanidoate,formic acid, cyano-, ethyl ester,cyanocarbonyloxyethane,ethylcyanidocarbonat,ethyl cyanoformate,ethyl cyanocarbonate |
| IUPAC Name | ethyl cyanoformate |
| InChI Key | MSMGXWFHBSCQFB-UHFFFAOYSA-N |
| Molecular Formula | C4H5NO2 |
2-Ketoglutaric acid, disodium salt, dihydrate, 99%
CAS: 305-72-6 Molecular Formula: C5H4Na2O5·2H2O Molecular Weight (g/mol): 226.1 MDL Number: MFCD00150702 InChI Key: YBGBJYVHJTVUSL-UHFFFAOYSA-L Synonym: disodium 2-oxoglutarate,unii-flp7p4rm46,disodium 2-oxopentanedioate,flp7p4rm46,pentanedioic acid, 2-oxo-, disodium salt,2-oxoglutaric acid disodium salt,2-ketoglutaric acid disodium salt,alpha-ketoglutaric acid sodium salt,disodium ? ketoglutarate,disodium oxoglurate PubChem CID: 31040 IUPAC Name: disodium;2-oxopentanedioate SMILES: C(CC(=O)[O-])C(=O)C(=O)[O-].[Na+].[Na+]
| PubChem CID | 31040 |
|---|---|
| CAS | 305-72-6 |
| Molecular Weight (g/mol) | 226.1 |
| MDL Number | MFCD00150702 |
| SMILES | C(CC(=O)[O-])C(=O)C(=O)[O-].[Na+].[Na+] |
| Synonym | disodium 2-oxoglutarate,unii-flp7p4rm46,disodium 2-oxopentanedioate,flp7p4rm46,pentanedioic acid, 2-oxo-, disodium salt,2-oxoglutaric acid disodium salt,2-ketoglutaric acid disodium salt,alpha-ketoglutaric acid sodium salt,disodium ? ketoglutarate,disodium oxoglurate |
| IUPAC Name | disodium;2-oxopentanedioate |
| InChI Key | YBGBJYVHJTVUSL-UHFFFAOYSA-L |
| Molecular Formula | C5H4Na2O5·2H2O |
Propionic Acid, BAKER™, J.T. Baker™
CAS: 79-09-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.079 InChI Key: XBDQKXXYIPTUBI-UHFFFAOYSA-N Synonym: propionic acid,ethylformic acid,methylacetic acid,carboxyethane,ethanecarboxylic acid,pseudoacetic acid,metacetonic acid,monoprop,luprosil,prozoin PubChem CID: 1032 ChEBI: CHEBI:30768 IUPAC Name: propanoic acid SMILES: CCC(=O)O
| PubChem CID | 1032 |
|---|---|
| CAS | 79-09-4 |
| Molecular Weight (g/mol) | 74.079 |
| ChEBI | CHEBI:30768 |
| SMILES | CCC(=O)O |
| Synonym | propionic acid,ethylformic acid,methylacetic acid,carboxyethane,ethanecarboxylic acid,pseudoacetic acid,metacetonic acid,monoprop,luprosil,prozoin |
| IUPAC Name | propanoic acid |
| InChI Key | XBDQKXXYIPTUBI-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2 |
Isopropyl palmitate, tech. 85%
CAS: 142-91-6 Molecular Formula: C19H38O2 Molecular Weight (g/mol): 298.51 MDL Number: MFCD00008993 InChI Key: XUGNVMKQXJXZCD-UHFFFAOYSA-N Synonym: isopropyl palmitate,isopropyl hexadecanoate,isopalm,deltyl,isopal,propal,deltyl prime,tegester isopalm,ja-fa ippkessco,sinnoester pit PubChem CID: 8907 ChEBI: CHEBI:84262 IUPAC Name: propan-2-yl hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OC(C)C
| PubChem CID | 8907 |
|---|---|
| CAS | 142-91-6 |
| Molecular Weight (g/mol) | 298.51 |
| ChEBI | CHEBI:84262 |
| MDL Number | MFCD00008993 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OC(C)C |
| Synonym | isopropyl palmitate,isopropyl hexadecanoate,isopalm,deltyl,isopal,propal,deltyl prime,tegester isopalm,ja-fa ippkessco,sinnoester pit |
| IUPAC Name | propan-2-yl hexadecanoate |
| InChI Key | XUGNVMKQXJXZCD-UHFFFAOYSA-N |
| Molecular Formula | C19H38O2 |
Carboplatin
CAS: 41575-94-4 Molecular Formula: C6H12N2O4Pt Molecular Weight (g/mol): 371.26 MDL Number: MFCD00070464 InChI Key: BHKICZDKIIDMNR-UHFFFAOYSA-L Synonym: carboplatin PubChem CID: 122130863 IUPAC Name: azanide;cyclobutane-1,1-dicarboxylate;platinum(4+) SMILES: N.N.O=C1O[Pt++]OC(=O)C11CCC1
| PubChem CID | 122130863 |
|---|---|
| CAS | 41575-94-4 |
| Molecular Weight (g/mol) | 371.26 |
| MDL Number | MFCD00070464 |
| SMILES | N.N.O=C1O[Pt++]OC(=O)C11CCC1 |
| Synonym | carboplatin |
| IUPAC Name | azanide;cyclobutane-1,1-dicarboxylate;platinum(4+) |
| InChI Key | BHKICZDKIIDMNR-UHFFFAOYSA-L |
| Molecular Formula | C6H12N2O4Pt |
4-Pyridineacetamide, 98%
CAS: 39640-62-5 Molecular Formula: C7H8N2O Molecular Weight (g/mol): 136.154 MDL Number: MFCD02685124 InChI Key: YEALAJQPOVKTOH-UHFFFAOYSA-N Synonym: 4-pyridineacetamide,2-pyridin-4-yl acetamide,pyridine-4-acetamide,acmc-20ajsz,4-pyridyl acetamide,4-pyridylacetic acid amide,2-pyridine-4-yl-acetamide PubChem CID: 227128 IUPAC Name: 2-pyridin-4-ylacetamide SMILES: C1=CN=CC=C1CC(=O)N
| PubChem CID | 227128 |
|---|---|
| CAS | 39640-62-5 |
| Molecular Weight (g/mol) | 136.154 |
| MDL Number | MFCD02685124 |
| SMILES | C1=CN=CC=C1CC(=O)N |
| Synonym | 4-pyridineacetamide,2-pyridin-4-yl acetamide,pyridine-4-acetamide,acmc-20ajsz,4-pyridyl acetamide,4-pyridylacetic acid amide,2-pyridine-4-yl-acetamide |
| IUPAC Name | 2-pyridin-4-ylacetamide |
| InChI Key | YEALAJQPOVKTOH-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O |
| CAS | 2832-10-2 |
|---|---|
| MDL Number | MFCD00009211 |
3-(3-Methylphenyl)propionic acid, 96%
CAS: 3751-48-2 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00060326 InChI Key: VWXVTHDQAOAENP-UHFFFAOYSA-N Synonym: 3-3-methylphenyl propionic acid,3-3-methylphenyl propanoic acid,3-m-tolyl propanoic acid,3-m-tolylpropionic acid,3-m-tolylpropanoic acid,propionic acid, 3-3-methylphenyl,3-m-tolyl-propionic acid,3-methylhydrocinnamic acid,hydrocinnamicacid,m-methyl,3-methylbenzenepropanoic acid PubChem CID: 138042 IUPAC Name: 3-(3-methylphenyl)propanoic acid SMILES: CC1=CC(=CC=C1)CCC(=O)O
| PubChem CID | 138042 |
|---|---|
| CAS | 3751-48-2 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00060326 |
| SMILES | CC1=CC(=CC=C1)CCC(=O)O |
| Synonym | 3-3-methylphenyl propionic acid,3-3-methylphenyl propanoic acid,3-m-tolyl propanoic acid,3-m-tolylpropionic acid,3-m-tolylpropanoic acid,propionic acid, 3-3-methylphenyl,3-m-tolyl-propionic acid,3-methylhydrocinnamic acid,hydrocinnamicacid,m-methyl,3-methylbenzenepropanoic acid |
| IUPAC Name | 3-(3-methylphenyl)propanoic acid |
| InChI Key | VWXVTHDQAOAENP-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
trans-4-Methylcyclohexanecarboxylic acid, 98%
CAS: 13064-83-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00074943,MFCD00074909,MFCD20617670 InChI Key: QTDXSEZXAPHVBI-UHFFFAOYSA-N Synonym: trans-4-methylcyclohexanecarboxylic acid,4-methylcyclohexanecarboxylic acid,4-methyl-1-cyclohexanecarboxylic acid,cis-4-methylcyclohexanecarboxylic acid,unii-70f0i2amtv,unii-m7dsk28350,trans-4-methyl-1-cyclohexanecarboxylic acid,trans-4-methyl hexahydrobenzoic acid,trans-4-methylcyclohexane carboxylic acid,70f0i2amtv PubChem CID: 20330 IUPAC Name: 4-methylcyclohexane-1-carboxylic acid SMILES: CC1CCC(CC1)C(O)=O
| PubChem CID | 20330 |
|---|---|
| CAS | 13064-83-0 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00074943,MFCD00074909,MFCD20617670 |
| SMILES | CC1CCC(CC1)C(O)=O |
| Synonym | trans-4-methylcyclohexanecarboxylic acid,4-methylcyclohexanecarboxylic acid,4-methyl-1-cyclohexanecarboxylic acid,cis-4-methylcyclohexanecarboxylic acid,unii-70f0i2amtv,unii-m7dsk28350,trans-4-methyl-1-cyclohexanecarboxylic acid,trans-4-methyl hexahydrobenzoic acid,trans-4-methylcyclohexane carboxylic acid,70f0i2amtv |
| IUPAC Name | 4-methylcyclohexane-1-carboxylic acid |
| InChI Key | QTDXSEZXAPHVBI-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
Pyridazine-3-carboxylic acid, 97%
CAS: 2164-61-6 Molecular Formula: C5H4N2O2 Molecular Weight (g/mol): 124.099 MDL Number: MFCD01646333 InChI Key: RUUOPSRRIKJHNH-UHFFFAOYSA-N Synonym: 3-pyridazinecarboxylic acid,3-carboxypyridazine,3-pyridazine carboxylic acid,pubchem22109,pyridazine carboxylic acid,ksc202q0p,pyridazine-3-carboxylic acid,3-carboxypyridazine; 3-pyridazinecarboxylic acid; PubChem CID: 269369 IUPAC Name: pyridazine-3-carboxylic acid SMILES: C1=CC(=NN=C1)C(=O)O
| PubChem CID | 269369 |
|---|---|
| CAS | 2164-61-6 |
| Molecular Weight (g/mol) | 124.099 |
| MDL Number | MFCD01646333 |
| SMILES | C1=CC(=NN=C1)C(=O)O |
| Synonym | 3-pyridazinecarboxylic acid,3-carboxypyridazine,3-pyridazine carboxylic acid,pubchem22109,pyridazine carboxylic acid,ksc202q0p,pyridazine-3-carboxylic acid,3-carboxypyridazine; 3-pyridazinecarboxylic acid; |
| IUPAC Name | pyridazine-3-carboxylic acid |
| InChI Key | RUUOPSRRIKJHNH-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2O2 |
Ethyl valerate, 99%
CAS: 539-82-2 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00009479 InChI Key: ICMAFTSLXCXHRK-UHFFFAOYSA-N Synonym: ethyl valerate,ethyl n-valerate,pentanoic acid, ethyl ester,valeric acid, ethyl ester,ethylvalerate,ethyl valerianate,pentanoic acid ethyl ester,n-valeric acid ethyl ester,valeric acid, ethyl ester 8ci,fema no. 2462 PubChem CID: 10882 IUPAC Name: ethyl pentanoate SMILES: CCCCC(=O)OCC
| PubChem CID | 10882 |
|---|---|
| CAS | 539-82-2 |
| Molecular Weight (g/mol) | 130.19 |
| MDL Number | MFCD00009479 |
| SMILES | CCCCC(=O)OCC |
| Synonym | ethyl valerate,ethyl n-valerate,pentanoic acid, ethyl ester,valeric acid, ethyl ester,ethylvalerate,ethyl valerianate,pentanoic acid ethyl ester,n-valeric acid ethyl ester,valeric acid, ethyl ester 8ci,fema no. 2462 |
| IUPAC Name | ethyl pentanoate |
| InChI Key | ICMAFTSLXCXHRK-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
Methyl hydrogen phthalate, 97%
CAS: 4376-18-5 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00002466 InChI Key: FNJSWIPFHMKRAT-UHFFFAOYSA-N Synonym: 2-methoxycarbonyl benzoic acid,methyl hydrogen phthalate,monomethyl phthalate,mono-methyl phthalate,phthalic acid monomethyl ester,o-methoxycarbonyl benzoic acid,monomethyl 1,2-benzenedicarboxylate,phthalic acid, monomethyl ester,monomethylphthalate,unii-2stt6d18jr PubChem CID: 20392 IUPAC Name: 2-methoxycarbonylbenzoic acid SMILES: COC(=O)C1=CC=CC=C1C(O)=O
| PubChem CID | 20392 |
|---|---|
| CAS | 4376-18-5 |
| Molecular Weight (g/mol) | 180.16 |
| MDL Number | MFCD00002466 |
| SMILES | COC(=O)C1=CC=CC=C1C(O)=O |
| Synonym | 2-methoxycarbonyl benzoic acid,methyl hydrogen phthalate,monomethyl phthalate,mono-methyl phthalate,phthalic acid monomethyl ester,o-methoxycarbonyl benzoic acid,monomethyl 1,2-benzenedicarboxylate,phthalic acid, monomethyl ester,monomethylphthalate,unii-2stt6d18jr |
| IUPAC Name | 2-methoxycarbonylbenzoic acid |
| InChI Key | FNJSWIPFHMKRAT-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |