Organic acids and derivatives
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Ethyl 2-Pyridylacetate 98.0+%, TCI America™
CAS: 2739-98-2 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00006359 InChI Key: IUDKTVXSXWAKJO-UHFFFAOYSA-N Synonym: ethyl 2-pyridylacetate,ethyl 2-pyridin-2-yl acetate,ethyl 2-pyridinylacetate,ethyl pyridine-2-acetate,2-pyridineacetic acid ethyl ester,ethyl 2-pyridineacetate,ethyl 2-2-pyridyl acetate,2-pyridylacetic acid ethyl ester,ethyl pyridin-2-ylacetate,2-pyridineacetic acid, ethyl ester PubChem CID: 75960 IUPAC Name: ethyl 2-pyridin-2-ylacetate SMILES: CCOC(=O)CC1=CC=CC=N1
| PubChem CID | 75960 |
|---|---|
| CAS | 2739-98-2 |
| Molecular Weight (g/mol) | 165.192 |
| MDL Number | MFCD00006359 |
| SMILES | CCOC(=O)CC1=CC=CC=N1 |
| Synonym | ethyl 2-pyridylacetate,ethyl 2-pyridin-2-yl acetate,ethyl 2-pyridinylacetate,ethyl pyridine-2-acetate,2-pyridineacetic acid ethyl ester,ethyl 2-pyridineacetate,ethyl 2-2-pyridyl acetate,2-pyridylacetic acid ethyl ester,ethyl pyridin-2-ylacetate,2-pyridineacetic acid, ethyl ester |
| IUPAC Name | ethyl 2-pyridin-2-ylacetate |
| InChI Key | IUDKTVXSXWAKJO-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |
1-Phenyloxindole 98.0+%, TCI America™
CAS: 3335-98-6 Molecular Formula: C14H11NO Molecular Weight (g/mol): 209.25 MDL Number: MFCD00234850 InChI Key: OWPNVXATCSXTBK-UHFFFAOYSA-N Synonym: 1-Phenyl-2-indolinone, 2-Oxo-1-phenylindoline PubChem CID: 314787 IUPAC Name: 1-phenyl-2,3-dihydro-1H-indol-2-one SMILES: O=C1CC2=CC=CC=C2N1C1=CC=CC=C1
| PubChem CID | 314787 |
|---|---|
| CAS | 3335-98-6 |
| Molecular Weight (g/mol) | 209.25 |
| MDL Number | MFCD00234850 |
| SMILES | O=C1CC2=CC=CC=C2N1C1=CC=CC=C1 |
| Synonym | 1-Phenyl-2-indolinone, 2-Oxo-1-phenylindoline |
| IUPAC Name | 1-phenyl-2,3-dihydro-1H-indol-2-one |
| InChI Key | OWPNVXATCSXTBK-UHFFFAOYSA-N |
| Molecular Formula | C14H11NO |
Isopropyl Methanesulfonate 98.0+%, TCI America™
CAS: 926-06-7 Molecular Formula: C4H10O3S Molecular Weight (g/mol): 138.181 MDL Number: MFCD00047802 InChI Key: SWWHCQCMVCPLEQ-UHFFFAOYSA-N Synonym: isopropyl methanesulfonate,isopropyl mesylate,isopropylmethanesulfonate,methanesulfonic acid, 1-methylethyl ester,isopropyl methane sulphonate,2-propyl methanesulphonate,isopropyl methane sulfonate,methanesulfonic acid, isopropyl ester,isopropyl methanesulphonate,unii-t0k2txy26b PubChem CID: 13551 IUPAC Name: propan-2-yl methanesulfonate SMILES: CC(C)OS(=O)(=O)C
| PubChem CID | 13551 |
|---|---|
| CAS | 926-06-7 |
| Molecular Weight (g/mol) | 138.181 |
| MDL Number | MFCD00047802 |
| SMILES | CC(C)OS(=O)(=O)C |
| Synonym | isopropyl methanesulfonate,isopropyl mesylate,isopropylmethanesulfonate,methanesulfonic acid, 1-methylethyl ester,isopropyl methane sulphonate,2-propyl methanesulphonate,isopropyl methane sulfonate,methanesulfonic acid, isopropyl ester,isopropyl methanesulphonate,unii-t0k2txy26b |
| IUPAC Name | propan-2-yl methanesulfonate |
| InChI Key | SWWHCQCMVCPLEQ-UHFFFAOYSA-N |
| Molecular Formula | C4H10O3S |
Diisopropyl Allylboronate 95.0+%, TCI America™
CAS: 51851-79-7 Molecular Formula: C9H19BO2 Molecular Weight (g/mol): 170.06 MDL Number: MFCD15072157 InChI Key: LWPLTONTMJTRJL-UHFFFAOYSA-N Synonym: Allylboronic Acid Diisopropyl Ester PubChem CID: 11435180 IUPAC Name: bis(propan-2-yl) (prop-2-en-1-yl)boronate SMILES: CC(C)OB(CC=C)OC(C)C
| PubChem CID | 11435180 |
|---|---|
| CAS | 51851-79-7 |
| Molecular Weight (g/mol) | 170.06 |
| MDL Number | MFCD15072157 |
| SMILES | CC(C)OB(CC=C)OC(C)C |
| Synonym | Allylboronic Acid Diisopropyl Ester |
| IUPAC Name | bis(propan-2-yl) (prop-2-en-1-yl)boronate |
| InChI Key | LWPLTONTMJTRJL-UHFFFAOYSA-N |
| Molecular Formula | C9H19BO2 |
Trimethyl Citrate 98.0+%, TCI America™
CAS: 1587-20-8 Molecular Formula: C9H14O7 Molecular Weight (g/mol): 234.204 MDL Number: MFCD00025889 InChI Key: HDDLVZWGOPWKFW-UHFFFAOYSA-N Synonym: Citric Acid Trimethyl Ester PubChem CID: 74112 IUPAC Name: trimethyl 2-hydroxypropane-1,2,3-tricarboxylate SMILES: COC(=O)CC(CC(=O)OC)(C(=O)OC)O
| PubChem CID | 74112 |
|---|---|
| CAS | 1587-20-8 |
| Molecular Weight (g/mol) | 234.204 |
| MDL Number | MFCD00025889 |
| SMILES | COC(=O)CC(CC(=O)OC)(C(=O)OC)O |
| Synonym | Citric Acid Trimethyl Ester |
| IUPAC Name | trimethyl 2-hydroxypropane-1,2,3-tricarboxylate |
| InChI Key | HDDLVZWGOPWKFW-UHFFFAOYSA-N |
| Molecular Formula | C9H14O7 |
6,11-Dihydrodibenzo[b,e]thiepin-11-one 98.0+%, TCI America™
CAS: 1531-77-7 Molecular Formula: C14H10OS Molecular Weight (g/mol): 226.293 MDL Number: MFCD02093738 InChI Key: JGJDEWXZEIHBNW-UHFFFAOYSA-N Synonym: dibenzo b,e thiepin-11 6h-one,6,11-dihydrodibenzo b,e thiepin-11-one,dibenz b,e thiepin-11 6h-one,6h-benzo c 1 benzothiepin-11-one,1-oxo-6,11-dihydrodibenzo b,e thiepin,dothiepinone,9-thiatricyclo 9.4.0.0 3 ,? pentadeca-1 15 ,3,5,7,11,13-hexaen-2-one,acmc-1buub PubChem CID: 73741 IUPAC Name: 6H-benzo[c][1]benzothiepin-11-one SMILES: C1C2=CC=CC=C2C(=O)C3=CC=CC=C3S1
| PubChem CID | 73741 |
|---|---|
| CAS | 1531-77-7 |
| Molecular Weight (g/mol) | 226.293 |
| MDL Number | MFCD02093738 |
| SMILES | C1C2=CC=CC=C2C(=O)C3=CC=CC=C3S1 |
| Synonym | dibenzo b,e thiepin-11 6h-one,6,11-dihydrodibenzo b,e thiepin-11-one,dibenz b,e thiepin-11 6h-one,6h-benzo c 1 benzothiepin-11-one,1-oxo-6,11-dihydrodibenzo b,e thiepin,dothiepinone,9-thiatricyclo 9.4.0.0 3 ,? pentadeca-1 15 ,3,5,7,11,13-hexaen-2-one,acmc-1buub |
| IUPAC Name | 6H-benzo[c][1]benzothiepin-11-one |
| InChI Key | JGJDEWXZEIHBNW-UHFFFAOYSA-N |
| Molecular Formula | C14H10OS |
Hexadecylphosphonic Acid 98.0+%, TCI America™
CAS: 4721-17-9 Molecular Formula: C16H35O3P Molecular Weight (g/mol): 306.427 MDL Number: MFCD00015836 InChI Key: JDPSFRXPDJVJMV-UHFFFAOYSA-N PubChem CID: 13783525 IUPAC Name: hexadecylphosphonic acid SMILES: CCCCCCCCCCCCCCCCP(=O)(O)O
| PubChem CID | 13783525 |
|---|---|
| CAS | 4721-17-9 |
| Molecular Weight (g/mol) | 306.427 |
| MDL Number | MFCD00015836 |
| SMILES | CCCCCCCCCCCCCCCCP(=O)(O)O |
| IUPAC Name | hexadecylphosphonic acid |
| InChI Key | JDPSFRXPDJVJMV-UHFFFAOYSA-N |
| Molecular Formula | C16H35O3P |
2-(Methylamino)isobutyric Acid Hydrate 98.0+%, TCI America™
CAS: 2566-34-9 Molecular Formula: C5H11NO2 Molecular Weight (g/mol): 117.148 MDL Number: MFCD00004191 InChI Key: DLAMVQGYEVKIRE-UHFFFAOYSA-N Synonym: 2-methylamino isobutyric acid,n,2-dimethylalanine,2-methyl-2-methylamino propanoic acid,alpha-methylamino isobutyric acid,meaib,alanine, n,2-dimethyl,n-methyl-a-aminoisobutyric acid,2-methylamino-2-methylpropionic acid,alpha-methylamino-isobutyric acid,2,n-dimethylalanine PubChem CID: 75725 IUPAC Name: 2-methyl-2-(methylamino)propanoic acid SMILES: CC(C)(C(=O)O)NC
| PubChem CID | 75725 |
|---|---|
| CAS | 2566-34-9 |
| Molecular Weight (g/mol) | 117.148 |
| MDL Number | MFCD00004191 |
| SMILES | CC(C)(C(=O)O)NC |
| Synonym | 2-methylamino isobutyric acid,n,2-dimethylalanine,2-methyl-2-methylamino propanoic acid,alpha-methylamino isobutyric acid,meaib,alanine, n,2-dimethyl,n-methyl-a-aminoisobutyric acid,2-methylamino-2-methylpropionic acid,alpha-methylamino-isobutyric acid,2,n-dimethylalanine |
| IUPAC Name | 2-methyl-2-(methylamino)propanoic acid |
| InChI Key | DLAMVQGYEVKIRE-UHFFFAOYSA-N |
| Molecular Formula | C5H11NO2 |
Dimethyl Tetrafluorosuccinate 95.0+%, TCI America™
CAS: 356-36-5 Molecular Formula: C6H6F4O4 Molecular Weight (g/mol): 218.104 MDL Number: MFCD00043947 InChI Key: RMXAYQBUNVSEPG-UHFFFAOYSA-N Synonym: Dimethyl Perfluorosuccinate, Perfluorosuccinic Acid Dimethyl Ester, Tetrafluorosuccinic Acid Dimethyl Ester, Dimethyl Tetrafluorobutanedioate, Tetrafluorobutanedioic Acid Dimethyl Ester PubChem CID: 2737124 IUPAC Name: dimethyl 2,2,3,3-tetrafluorobutanedioate SMILES: COC(=O)C(C(C(=O)OC)(F)F)(F)F
| PubChem CID | 2737124 |
|---|---|
| CAS | 356-36-5 |
| Molecular Weight (g/mol) | 218.104 |
| MDL Number | MFCD00043947 |
| SMILES | COC(=O)C(C(C(=O)OC)(F)F)(F)F |
| Synonym | Dimethyl Perfluorosuccinate, Perfluorosuccinic Acid Dimethyl Ester, Tetrafluorosuccinic Acid Dimethyl Ester, Dimethyl Tetrafluorobutanedioate, Tetrafluorobutanedioic Acid Dimethyl Ester |
| IUPAC Name | dimethyl 2,2,3,3-tetrafluorobutanedioate |
| InChI Key | RMXAYQBUNVSEPG-UHFFFAOYSA-N |
| Molecular Formula | C6H6F4O4 |
Methyl Difluoroacetate 97.0+%, TCI America™
CAS: 433-53-4 Molecular Formula: C3H4F2O2 Molecular Weight (g/mol): 110.06 MDL Number: MFCD00039276 InChI Key: CSSYKHYGURSRAZ-UHFFFAOYSA-N Synonym: methyl difluoroacetate,methyl2,2-difluoroacetate,difluoroacetic acid methyl ester,acetic acid, difluoro-, methyl ester,methyldifluoroacetate,methyl difluoroacetate #,acmc-209ju0,methyl 2,2-difluoroethanoate PubChem CID: 79012 IUPAC Name: methyl 2,2-difluoroacetate SMILES: COC(=O)C(F)F
| PubChem CID | 79012 |
|---|---|
| CAS | 433-53-4 |
| Molecular Weight (g/mol) | 110.06 |
| MDL Number | MFCD00039276 |
| SMILES | COC(=O)C(F)F |
| Synonym | methyl difluoroacetate,methyl2,2-difluoroacetate,difluoroacetic acid methyl ester,acetic acid, difluoro-, methyl ester,methyldifluoroacetate,methyl difluoroacetate #,acmc-209ju0,methyl 2,2-difluoroethanoate |
| IUPAC Name | methyl 2,2-difluoroacetate |
| InChI Key | CSSYKHYGURSRAZ-UHFFFAOYSA-N |
| Molecular Formula | C3H4F2O2 |
cis-3-Hexenyl Pyruvate 95.0+%, TCI America™
CAS: 68133-76-6 Molecular Formula: C9H14O3 Molecular Weight (g/mol): 170.21 MDL Number: MFCD00036527 InChI Key: LKNXTZXOBHAYSR-PLNGDYQASA-N Synonym: Pyruvic Acid cis-3-Hexenyl Ester PubChem CID: 5363291 IUPAC Name: (3Z)-hex-3-en-1-yl 2-oxopropanoate SMILES: CC\C=C/CCOC(=O)C(C)=O
| PubChem CID | 5363291 |
|---|---|
| CAS | 68133-76-6 |
| Molecular Weight (g/mol) | 170.21 |
| MDL Number | MFCD00036527 |
| SMILES | CC\C=C/CCOC(=O)C(C)=O |
| Synonym | Pyruvic Acid cis-3-Hexenyl Ester |
| IUPAC Name | (3Z)-hex-3-en-1-yl 2-oxopropanoate |
| InChI Key | LKNXTZXOBHAYSR-PLNGDYQASA-N |
| Molecular Formula | C9H14O3 |
1-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole 98.0+%, TCI America™
CAS: 847818-74-0 Molecular Formula: C10H17BN2O2 Molecular Weight (g/mol): 208.07 MDL Number: MFCD05861380 InChI Key: HLXOVAMYQUFLPE-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-5-boronic acid pinacol ester,1-methyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-methyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,1-methyl-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1h-pyrazole,1-methylpyrazole-5-boronic acid pinacol ester,cbi-bb zero/005567,1h-pyrazole, 1-methyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,1-methyl-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,1-methyl-5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,4,4,5,5-tetramethyl-2-1-methylpyrazol-5-yl-1,3,2-dioxaborolane PubChem CID: 4912908 IUPAC Name: 1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole SMILES: CN1N=CC=C1B1OC(C)(C)C(C)(C)O1
| PubChem CID | 4912908 |
|---|---|
| CAS | 847818-74-0 |
| Molecular Weight (g/mol) | 208.07 |
| MDL Number | MFCD05861380 |
| SMILES | CN1N=CC=C1B1OC(C)(C)C(C)(C)O1 |
| Synonym | 1-methyl-1h-pyrazole-5-boronic acid pinacol ester,1-methyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-methyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,1-methyl-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1h-pyrazole,1-methylpyrazole-5-boronic acid pinacol ester,cbi-bb zero/005567,1h-pyrazole, 1-methyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,1-methyl-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,1-methyl-5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,4,4,5,5-tetramethyl-2-1-methylpyrazol-5-yl-1,3,2-dioxaborolane |
| IUPAC Name | 1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole |
| InChI Key | HLXOVAMYQUFLPE-UHFFFAOYSA-N |
| Molecular Formula | C10H17BN2O2 |
Butyl Laurate 99.0+%, TCI America™
CAS: 106-18-3 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00042870 InChI Key: NDKYEUQMPZIGFN-UHFFFAOYSA-N Synonym: butyl laurate,dodecanoic acid, butyl ester,n-butyl laurate,bytyl laurate,butyl dodecylate,lauric acid butyl ester,lauric acid, butyl ester,lauric acid n-butyl ester,unii-23985ocm4h,n-butyl n-dodecanoate PubChem CID: 61015 IUPAC Name: butyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OCCCC
| PubChem CID | 61015 |
|---|---|
| CAS | 106-18-3 |
| Molecular Weight (g/mol) | 256.43 |
| MDL Number | MFCD00042870 |
| SMILES | CCCCCCCCCCCC(=O)OCCCC |
| Synonym | butyl laurate,dodecanoic acid, butyl ester,n-butyl laurate,bytyl laurate,butyl dodecylate,lauric acid butyl ester,lauric acid, butyl ester,lauric acid n-butyl ester,unii-23985ocm4h,n-butyl n-dodecanoate |
| IUPAC Name | butyl dodecanoate |
| InChI Key | NDKYEUQMPZIGFN-UHFFFAOYSA-N |
| Molecular Formula | C16H32O2 |
Dimethyl Hexafluoroglutarate 96.0+%, TCI America™
CAS: 1513-62-8 Molecular Formula: C7H6F6O4 Molecular Weight (g/mol): 268.111 MDL Number: MFCD00155851 InChI Key: PJZVBCPDYSZAJU-UHFFFAOYSA-N Synonym: Dimethyl Perfluoroglutarate, Dimethyl Hexafluoropentanedioate, Hexafluoroglutaric Acid Dimethyl Ester, Perfluoroglutaric Acid Dimethyl Ester, Hexafluoropentanedioic Acid Dimethyl Ester PubChem CID: 123116 IUPAC Name: dimethyl 2,2,3,3,4,4-hexafluoropentanedioate SMILES: COC(=O)C(C(C(C(=O)OC)(F)F)(F)F)(F)F
| PubChem CID | 123116 |
|---|---|
| CAS | 1513-62-8 |
| Molecular Weight (g/mol) | 268.111 |
| MDL Number | MFCD00155851 |
| SMILES | COC(=O)C(C(C(C(=O)OC)(F)F)(F)F)(F)F |
| Synonym | Dimethyl Perfluoroglutarate, Dimethyl Hexafluoropentanedioate, Hexafluoroglutaric Acid Dimethyl Ester, Perfluoroglutaric Acid Dimethyl Ester, Hexafluoropentanedioic Acid Dimethyl Ester |
| IUPAC Name | dimethyl 2,2,3,3,4,4-hexafluoropentanedioate |
| InChI Key | PJZVBCPDYSZAJU-UHFFFAOYSA-N |
| Molecular Formula | C7H6F6O4 |
4'-Fluoro-2'-nitroacetanilide 98.0+%, TCI America™
CAS: 448-39-5 Molecular Formula: C8H7FN2O3 Molecular Weight (g/mol): 198.153 MDL Number: MFCD00031517 InChI Key: UZBZEUCQENVPQB-UHFFFAOYSA-N Synonym: 4'-fluoro-2'-nitroacetanilide,n-4-fluoro-2-nitrophenyl acetamide,4-fluoro-2-nitroacetanilide,maybridge1_003501,4/'-fluoro-2/'-nitroacetanilide,labotest-bb lt00455473,labotest-bb lt03332301,acetamide,n-4-fluoro-2-nitrophenyl,n-4-fluoro-2-nitro-phenyl-acetamide,n-4-fluoro-2-nitrophenyl acetamide # PubChem CID: 136289 IUPAC Name: N-(4-fluoro-2-nitrophenyl)acetamide SMILES: CC(=O)NC1=C(C=C(C=C1)F)[N+](=O)[O-]
| PubChem CID | 136289 |
|---|---|
| CAS | 448-39-5 |
| Molecular Weight (g/mol) | 198.153 |
| MDL Number | MFCD00031517 |
| SMILES | CC(=O)NC1=C(C=C(C=C1)F)[N+](=O)[O-] |
| Synonym | 4'-fluoro-2'-nitroacetanilide,n-4-fluoro-2-nitrophenyl acetamide,4-fluoro-2-nitroacetanilide,maybridge1_003501,4/'-fluoro-2/'-nitroacetanilide,labotest-bb lt00455473,labotest-bb lt03332301,acetamide,n-4-fluoro-2-nitrophenyl,n-4-fluoro-2-nitro-phenyl-acetamide,n-4-fluoro-2-nitrophenyl acetamide # |
| IUPAC Name | N-(4-fluoro-2-nitrophenyl)acetamide |
| InChI Key | UZBZEUCQENVPQB-UHFFFAOYSA-N |
| Molecular Formula | C8H7FN2O3 |