Organic acids and derivatives
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2-Ethylhexyl acetate, 99%, pure
CAS: 103-09-3 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.27 MDL Number: MFCD00027249 InChI Key: WOYWLLHHWAMFCB-UHFFFAOYNA-N Synonym: acetic acid, 2-ethylhexyl ester,2-ethyl-1-hexanol acetate,2-ethylhexyl ethanoate,2-ethyl-1-hexyl acetate,2-ethylhexanyl acetate,2-ethylhexylacetate,beta-ethylhexyl acetate,acetic acid 2-ethylhexyl ester,fema number 2806,2-ethylhexylester kyseliny octove PubChem CID: 7635 ChEBI: CHEBI:87392 IUPAC Name: 2-ethylhexyl acetate SMILES: CCCCC(CC)COC(C)=O
| PubChem CID | 7635 |
|---|---|
| CAS | 103-09-3 |
| Molecular Weight (g/mol) | 172.27 |
| ChEBI | CHEBI:87392 |
| MDL Number | MFCD00027249 |
| SMILES | CCCCC(CC)COC(C)=O |
| Synonym | acetic acid, 2-ethylhexyl ester,2-ethyl-1-hexanol acetate,2-ethylhexyl ethanoate,2-ethyl-1-hexyl acetate,2-ethylhexanyl acetate,2-ethylhexylacetate,beta-ethylhexyl acetate,acetic acid 2-ethylhexyl ester,fema number 2806,2-ethylhexylester kyseliny octove |
| IUPAC Name | 2-ethylhexyl acetate |
| InChI Key | WOYWLLHHWAMFCB-UHFFFAOYNA-N |
| Molecular Formula | C10H20O2 |
Diethyl carbonate, 99%, anhydrous, AcroSeal™
CAS: 105-58-8 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 MDL Number: MFCD00009107 InChI Key: OIFBSDVPJOWBCH-UHFFFAOYSA-N Synonym: ethyl carbonate,carbonic acid, diethyl ester,carbonic acid diethyl ester,eufin,diatol,diaethylcarbonat,carbonic ether,ethoxyformic anhydride,diethylkarbonat,ethyl carbonate eto 2co PubChem CID: 7766 IUPAC Name: diethyl carbonate SMILES: CCOC(=O)OCC
| PubChem CID | 7766 |
|---|---|
| CAS | 105-58-8 |
| Molecular Weight (g/mol) | 118.13 |
| MDL Number | MFCD00009107 |
| SMILES | CCOC(=O)OCC |
| Synonym | ethyl carbonate,carbonic acid, diethyl ester,carbonic acid diethyl ester,eufin,diatol,diaethylcarbonat,carbonic ether,ethoxyformic anhydride,diethylkarbonat,ethyl carbonate eto 2co |
| IUPAC Name | diethyl carbonate |
| InChI Key | OIFBSDVPJOWBCH-UHFFFAOYSA-N |
| Molecular Formula | C5H10O3 |
Methyl alpha-chloroacrylate, 98+%, stabilized with hydroquinone
CAS: 80-63-7 Molecular Formula: C4H5ClO2 Molecular Weight (g/mol): 120.54 MDL Number: MFCD00051368 InChI Key: AWJZTPWDQYFQPQ-UHFFFAOYSA-N Synonym: methyl 2-chloroacrylate,methyl alpha-chloroacrylate,methyl-2-chloroacrylate,2-propenoic acid, 2-chloro-, methyl ester,methyl-alpha-chloroacrylate,2-chloroacrylic acid, methyl ester,methyl 2-chloro-2-propenoate,acrylic acid, 2-chloro-, methyl ester,methyl 2-chloro-2-propenate,unii-47pg4l077j PubChem CID: 6659 IUPAC Name: methyl 2-chloroprop-2-enoate SMILES: COC(=O)C(=C)Cl
| PubChem CID | 6659 |
|---|---|
| CAS | 80-63-7 |
| Molecular Weight (g/mol) | 120.54 |
| MDL Number | MFCD00051368 |
| SMILES | COC(=O)C(=C)Cl |
| Synonym | methyl 2-chloroacrylate,methyl alpha-chloroacrylate,methyl-2-chloroacrylate,2-propenoic acid, 2-chloro-, methyl ester,methyl-alpha-chloroacrylate,2-chloroacrylic acid, methyl ester,methyl 2-chloro-2-propenoate,acrylic acid, 2-chloro-, methyl ester,methyl 2-chloro-2-propenate,unii-47pg4l077j |
| IUPAC Name | methyl 2-chloroprop-2-enoate |
| InChI Key | AWJZTPWDQYFQPQ-UHFFFAOYSA-N |
| Molecular Formula | C4H5ClO2 |
3-Amino-1H-pyrazole-4-carboxylic acid, 95%, Thermo Scientific Chemicals
CAS: 41680-34-6 Molecular Formula: C4H5N3O2 Molecular Weight (g/mol): 127.103 MDL Number: MFCD00005239 InChI Key: KMRVTZLKQPFHFS-UHFFFAOYSA-N Synonym: 3-amino-1h-pyrazole-4-carboxylic acid,3-aminopyrazole-4-carboxylic acid,3-amino-4-pyrazolecarboxylic acid,3-amino-4-carboxypyrazole,1h-pyrazole-4-carboxylic acid, 3-amino,4-pyrazolecarboxylic acid, 3-amino,pyrazole-4-carboxylic acid, 3-amino,3-aminopyrazole-4-carboxylicacid,3-amino-4-pyrazole carboxylic acid,5-aminopyrazole-4-carboxylic acid PubChem CID: 96774 IUPAC Name: 5-amino-1H-pyrazole-4-carboxylic acid SMILES: C1=NNC(=C1C(=O)O)N
| PubChem CID | 96774 |
|---|---|
| CAS | 41680-34-6 |
| Molecular Weight (g/mol) | 127.103 |
| MDL Number | MFCD00005239 |
| SMILES | C1=NNC(=C1C(=O)O)N |
| Synonym | 3-amino-1h-pyrazole-4-carboxylic acid,3-aminopyrazole-4-carboxylic acid,3-amino-4-pyrazolecarboxylic acid,3-amino-4-carboxypyrazole,1h-pyrazole-4-carboxylic acid, 3-amino,4-pyrazolecarboxylic acid, 3-amino,pyrazole-4-carboxylic acid, 3-amino,3-aminopyrazole-4-carboxylicacid,3-amino-4-pyrazole carboxylic acid,5-aminopyrazole-4-carboxylic acid |
| IUPAC Name | 5-amino-1H-pyrazole-4-carboxylic acid |
| InChI Key | KMRVTZLKQPFHFS-UHFFFAOYSA-N |
| Molecular Formula | C4H5N3O2 |
4'-Aminobenzanilide, 97%
CAS: 17625-83-1 Molecular Formula: C13H12N2O Molecular Weight (g/mol): 212.252 MDL Number: MFCD00035777 InChI Key: GTTFJYUWPUKXJH-UHFFFAOYSA-N Synonym: 4'-aminobenzanilide,n-4-aminophenyl benzamide,benzamide, n-4-aminophenyl,4,4'-diaminobenzoylanilide,n-4-amino-phenyl-benzamide,n-4-aminophenyl-benzamide,4-aminobenzanilide,4/'-aminobenzanilide,acmc-209xfr,n-benzoyl 4-aminoaniline PubChem CID: 87196 IUPAC Name: N-(4-aminophenyl)benzamide SMILES: C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N
| PubChem CID | 87196 |
|---|---|
| CAS | 17625-83-1 |
| Molecular Weight (g/mol) | 212.252 |
| MDL Number | MFCD00035777 |
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N |
| Synonym | 4'-aminobenzanilide,n-4-aminophenyl benzamide,benzamide, n-4-aminophenyl,4,4'-diaminobenzoylanilide,n-4-amino-phenyl-benzamide,n-4-aminophenyl-benzamide,4-aminobenzanilide,4/'-aminobenzanilide,acmc-209xfr,n-benzoyl 4-aminoaniline |
| IUPAC Name | N-(4-aminophenyl)benzamide |
| InChI Key | GTTFJYUWPUKXJH-UHFFFAOYSA-N |
| Molecular Formula | C13H12N2O |
4-Cyano-3-fluorobenzeneboronic acid, 97%
CAS: 843663-18-3 Molecular Formula: C7H5BFNO2 Molecular Weight (g/mol): 164.93 MDL Number: MFCD03411549 InChI Key: DECWLXUOZUMPBF-UHFFFAOYSA-N Synonym: 4-cyano-3-fluorobenzeneboronic acid,4-cyano-3-fluorophenyl boronic acid,4-borono-2-fluorobenzonitrile,4-cyano-3-fluoro-phenyl boronic acid,4-cyano-3-fluoro phenyl boronic acid,3-fluoro-4-cyanophenylboronic acid,boronic acid, 4-cyano-3-fluorophenyl,4-cyano-3-fluorophenylboronicacid,pubchem1801,acmc-209pug PubChem CID: 2783130 IUPAC Name: (4-cyano-3-fluorophenyl)boronic acid SMILES: OB(O)C1=CC(F)=C(C=C1)C#N
| PubChem CID | 2783130 |
|---|---|
| CAS | 843663-18-3 |
| Molecular Weight (g/mol) | 164.93 |
| MDL Number | MFCD03411549 |
| SMILES | OB(O)C1=CC(F)=C(C=C1)C#N |
| Synonym | 4-cyano-3-fluorobenzeneboronic acid,4-cyano-3-fluorophenyl boronic acid,4-borono-2-fluorobenzonitrile,4-cyano-3-fluoro-phenyl boronic acid,4-cyano-3-fluoro phenyl boronic acid,3-fluoro-4-cyanophenylboronic acid,boronic acid, 4-cyano-3-fluorophenyl,4-cyano-3-fluorophenylboronicacid,pubchem1801,acmc-209pug |
| IUPAC Name | (4-cyano-3-fluorophenyl)boronic acid |
| InChI Key | DECWLXUOZUMPBF-UHFFFAOYSA-N |
| Molecular Formula | C7H5BFNO2 |
3-Pyridineacetamide, 99%
CAS: 3724-16-1 Molecular Formula: C7H8N2O Molecular Weight (g/mol): 136.154 MDL Number: MFCD08236789 InChI Key: YDHIMEXEGOCNHU-UHFFFAOYSA-N Synonym: 2-pyridin-3-yl acetamide,3-pyridineacetamide,pyridine-3-acetamide,2-3-pyridyl acetamide,2-pyridine-3-yl-acetamide,3-pyridine acetamide,3-pyridylacetamide,acmc-1cs2v,2-3-pyridinyl acetamide,2-pyridin-3-yl acetamid PubChem CID: 564767 IUPAC Name: 2-pyridin-3-ylacetamide SMILES: C1=CC(=CN=C1)CC(=O)N
| PubChem CID | 564767 |
|---|---|
| CAS | 3724-16-1 |
| Molecular Weight (g/mol) | 136.154 |
| MDL Number | MFCD08236789 |
| SMILES | C1=CC(=CN=C1)CC(=O)N |
| Synonym | 2-pyridin-3-yl acetamide,3-pyridineacetamide,pyridine-3-acetamide,2-3-pyridyl acetamide,2-pyridine-3-yl-acetamide,3-pyridine acetamide,3-pyridylacetamide,acmc-1cs2v,2-3-pyridinyl acetamide,2-pyridin-3-yl acetamid |
| IUPAC Name | 2-pyridin-3-ylacetamide |
| InChI Key | YDHIMEXEGOCNHU-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O |
2,2-Difluoropropionic acid, 97%, Thermo Scientific Chemicals
CAS: 373-96-6 Molecular Formula: C3H4F2O2 Molecular Weight (g/mol): 110.06 MDL Number: MFCD03093764 InChI Key: PMWGIVRHUIAIII-UHFFFAOYSA-N Synonym: 2,2-difluoropropionic acid,2,2-difluoropropionicacid,2,2-difluoro-propionic acid,propanoic acid, 2,2-difluoro,acmc-1ctsu,2,2-difluorpropionic acid PubChem CID: 2782825 IUPAC Name: 2,2-difluoropropanoic acid SMILES: CC(F)(F)C(O)=O
| PubChem CID | 2782825 |
|---|---|
| CAS | 373-96-6 |
| Molecular Weight (g/mol) | 110.06 |
| MDL Number | MFCD03093764 |
| SMILES | CC(F)(F)C(O)=O |
| Synonym | 2,2-difluoropropionic acid,2,2-difluoropropionicacid,2,2-difluoro-propionic acid,propanoic acid, 2,2-difluoro,acmc-1ctsu,2,2-difluorpropionic acid |
| IUPAC Name | 2,2-difluoropropanoic acid |
| InChI Key | PMWGIVRHUIAIII-UHFFFAOYSA-N |
| Molecular Formula | C3H4F2O2 |
Methyl 2-nonynoate, 98%, Thermo Scientific Chemicals
CAS: 111-80-8 Molecular Formula: C10H16O2 Molecular Weight (g/mol): 168.236 MDL Number: MFCD00009547 InChI Key: NTLJTUMJJWVCTL-UHFFFAOYSA-N Synonym: methyl 2-nonynoate,2-nonynoic acid methyl ester,methyl octine carbonate,methyl octyne carbonate,2-nonynoic acid, methyl ester,methyloctyne carboxylate,methyloctyne carbonate,methyl octin carbonate,octynecarboxylic acid, methyl ester,methyl octynecarboxylate PubChem CID: 8137 ChEBI: CHEBI:51749 IUPAC Name: methyl non-2-ynoate SMILES: CCCCCCC#CC(=O)OC
| PubChem CID | 8137 |
|---|---|
| CAS | 111-80-8 |
| Molecular Weight (g/mol) | 168.236 |
| ChEBI | CHEBI:51749 |
| MDL Number | MFCD00009547 |
| SMILES | CCCCCCC#CC(=O)OC |
| Synonym | methyl 2-nonynoate,2-nonynoic acid methyl ester,methyl octine carbonate,methyl octyne carbonate,2-nonynoic acid, methyl ester,methyloctyne carboxylate,methyloctyne carbonate,methyl octin carbonate,octynecarboxylic acid, methyl ester,methyl octynecarboxylate |
| IUPAC Name | methyl non-2-ynoate |
| InChI Key | NTLJTUMJJWVCTL-UHFFFAOYSA-N |
| Molecular Formula | C10H16O2 |
2-Furamide, 97%
CAS: 609-38-1 Molecular Formula: C5H5NO2 Molecular Weight (g/mol): 111.1 MDL Number: MFCD00236147 InChI Key: TVFIYRKPCACCNL-UHFFFAOYSA-N Synonym: 2-furamide,furamide,2-furancarboxamide,furfurylamide,2-furoamide,furoylamide,unii-8ig4632c1y,furancarboxamide,acmc-20anu6 PubChem CID: 69108 IUPAC Name: furan-2-carboxamide SMILES: C1=COC(=C1)C(=O)N
| PubChem CID | 69108 |
|---|---|
| CAS | 609-38-1 |
| Molecular Weight (g/mol) | 111.1 |
| MDL Number | MFCD00236147 |
| SMILES | C1=COC(=C1)C(=O)N |
| Synonym | 2-furamide,furamide,2-furancarboxamide,furfurylamide,2-furoamide,furoylamide,unii-8ig4632c1y,furancarboxamide,acmc-20anu6 |
| IUPAC Name | furan-2-carboxamide |
| InChI Key | TVFIYRKPCACCNL-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO2 |
Bismuth subgallate hydrate
CAS: 342406-26-2 Molecular Formula: C7H5BiO6 Molecular Weight (g/mol): 394.09 MDL Number: MFCD00044980 InChI Key: JAONZGLTYYUPCT-UHFFFAOYSA-K Synonym: bismuth subgallate,wismutgallathydroxid,dermatol,bismuth gallate,dermatol puder,bismuth subgallas,bismutum subgallicum,basic bismuth gallate,gallic acid bismuth basic salt,wismutgallat, basisches PubChem CID: 16682999 IUPAC Name: 4-hydroxy-1,3,2$l^{2}-benzodioxabismole-6-carboxylic acid;hydrate SMILES: O[Bi]1OC2=C(O1)C(O)=CC(=C2)C(O)=O
| PubChem CID | 16682999 |
|---|---|
| CAS | 342406-26-2 |
| Molecular Weight (g/mol) | 394.09 |
| MDL Number | MFCD00044980 |
| SMILES | O[Bi]1OC2=C(O1)C(O)=CC(=C2)C(O)=O |
| Synonym | bismuth subgallate,wismutgallathydroxid,dermatol,bismuth gallate,dermatol puder,bismuth subgallas,bismutum subgallicum,basic bismuth gallate,gallic acid bismuth basic salt,wismutgallat, basisches |
| IUPAC Name | 4-hydroxy-1,3,2$l^{2}-benzodioxabismole-6-carboxylic acid;hydrate |
| InChI Key | JAONZGLTYYUPCT-UHFFFAOYSA-K |
| Molecular Formula | C7H5BiO6 |
N-Acetylmorpholine, 98%
CAS: 1696-20-4 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.159 MDL Number: MFCD00006171 InChI Key: KYWXRBNOYGGPIZ-UHFFFAOYSA-N Synonym: 4-acetylmorpholine,n-acetylmorpholine,1-morpholinoethanone,morpholine, 4-acetyl,n-acetylmorfolin,n-acetylmorfolin czech,ethanone, 1-4-morpholinyl,n-acetyl morpholine,1-morpholin-4-yl ethan-1-one,acetylmorpholine PubChem CID: 15543 IUPAC Name: 1-morpholin-4-ylethanone SMILES: CC(=O)N1CCOCC1
| PubChem CID | 15543 |
|---|---|
| CAS | 1696-20-4 |
| Molecular Weight (g/mol) | 129.159 |
| MDL Number | MFCD00006171 |
| SMILES | CC(=O)N1CCOCC1 |
| Synonym | 4-acetylmorpholine,n-acetylmorpholine,1-morpholinoethanone,morpholine, 4-acetyl,n-acetylmorfolin,n-acetylmorfolin czech,ethanone, 1-4-morpholinyl,n-acetyl morpholine,1-morpholin-4-yl ethan-1-one,acetylmorpholine |
| IUPAC Name | 1-morpholin-4-ylethanone |
| InChI Key | KYWXRBNOYGGPIZ-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO2 |
alpha,alpha-Difluorophenylacetic acid, 97%
CAS: 360-03-2 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD00498146 InChI Key: PFKSLFZFBCIJOI-UHFFFAOYSA-N PubChem CID: 726153 IUPAC Name: 2,2-difluoro-2-phenylacetic acid SMILES: C1=CC=C(C=C1)C(C(=O)O)(F)F
| PubChem CID | 726153 |
|---|---|
| CAS | 360-03-2 |
| Molecular Weight (g/mol) | 172.131 |
| MDL Number | MFCD00498146 |
| SMILES | C1=CC=C(C=C1)C(C(=O)O)(F)F |
| IUPAC Name | 2,2-difluoro-2-phenylacetic acid |
| InChI Key | PFKSLFZFBCIJOI-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O2 |
Ethyl 2-cyano-2-methylpropionate, 97%
CAS: 1572-98-1 Molecular Formula: C7H11NO2 Molecular Weight (g/mol): 141.17 MDL Number: MFCD00034667 InChI Key: FYGRPGOHQCPZCV-UHFFFAOYSA-N PubChem CID: 344887 IUPAC Name: ethyl 2-cyano-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)C#N
| PubChem CID | 344887 |
|---|---|
| CAS | 1572-98-1 |
| Molecular Weight (g/mol) | 141.17 |
| MDL Number | MFCD00034667 |
| SMILES | CCOC(=O)C(C)(C)C#N |
| IUPAC Name | ethyl 2-cyano-2-methylpropanoate |
| InChI Key | FYGRPGOHQCPZCV-UHFFFAOYSA-N |
| Molecular Formula | C7H11NO2 |
Methyl 2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, 98%
CAS: 108354-78-5 Molecular Formula: C10H13NO2S Molecular Weight (g/mol): 211.279 MDL Number: MFCD00130099 InChI Key: DKYYKIHEIOOWRB-UHFFFAOYSA-N Synonym: methyl 2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carboxylate,2-amino-4,5,6,7-tetrahydro-benzo b thiophene-3-carboxylic acid methyl ester,2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carboxylic acid methyl ester,2-amino-4,5,6,7-tetrahydro-benzo b thiophene-3,cbmicro_029799,methyl 2-azanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate,methyl-2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carboxylate,2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester,methyl 2-amino-4, 5, 6, 7-tetrahydro-1-benzothiophene-3-carboxylate,methyl 2-amino-4,5,6,7-tetrahydro-1-benzo b thiophene-3-carboxylate PubChem CID: 2756552 IUPAC Name: methyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate SMILES: COC(=O)C1=C(SC2=C1CCCC2)N
| PubChem CID | 2756552 |
|---|---|
| CAS | 108354-78-5 |
| Molecular Weight (g/mol) | 211.279 |
| MDL Number | MFCD00130099 |
| SMILES | COC(=O)C1=C(SC2=C1CCCC2)N |
| Synonym | methyl 2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carboxylate,2-amino-4,5,6,7-tetrahydro-benzo b thiophene-3-carboxylic acid methyl ester,2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carboxylic acid methyl ester,2-amino-4,5,6,7-tetrahydro-benzo b thiophene-3,cbmicro_029799,methyl 2-azanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate,methyl-2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carboxylate,2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester,methyl 2-amino-4, 5, 6, 7-tetrahydro-1-benzothiophene-3-carboxylate,methyl 2-amino-4,5,6,7-tetrahydro-1-benzo b thiophene-3-carboxylate |
| IUPAC Name | methyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| InChI Key | DKYYKIHEIOOWRB-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO2S |