Organic acids and derivatives
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Methyl 2-(2,6-Dichloroanilino)phenylacetate 97.0+%, TCI America™
CAS: 15307-78-5 Molecular Formula: C15H13Cl2NO2 Molecular Weight (g/mol): 310.174 MDL Number: MFCD08273811 InChI Key: VETACGBDFVVKGZ-UHFFFAOYSA-N Synonym: 2-(2,6-Dichloroanilino)phenylacetic Acid Methyl Ester, Diclofenac Methyl Ester PubChem CID: 519102 IUPAC Name: methyl 2-[2-(2,6-dichloroanilino)phenyl]acetate SMILES: COC(=O)CC1=CC=CC=C1NC2=C(C=CC=C2Cl)Cl
| PubChem CID | 519102 |
|---|---|
| CAS | 15307-78-5 |
| Molecular Weight (g/mol) | 310.174 |
| MDL Number | MFCD08273811 |
| SMILES | COC(=O)CC1=CC=CC=C1NC2=C(C=CC=C2Cl)Cl |
| Synonym | 2-(2,6-Dichloroanilino)phenylacetic Acid Methyl Ester, Diclofenac Methyl Ester |
| IUPAC Name | methyl 2-[2-(2,6-dichloroanilino)phenyl]acetate |
| InChI Key | VETACGBDFVVKGZ-UHFFFAOYSA-N |
| Molecular Formula | C15H13Cl2NO2 |
Dimethyl Citraconate 99.0+%, TCI America™
CAS: 617-54-9 Molecular Formula: C7H10O4 Molecular Weight (g/mol): 158.15 MDL Number: MFCD00059306 InChI Key: WQEXBUQDXKPVHR-SNAWJCMRSA-N Synonym: Citraconic Acid Dimethyl Ester PubChem CID: 5355715 IUPAC Name: 1,4-dimethyl (2E)-2-methylbut-2-enedioate SMILES: COC(=O)\C=C(/C)C(=O)OC
| PubChem CID | 5355715 |
|---|---|
| CAS | 617-54-9 |
| Molecular Weight (g/mol) | 158.15 |
| MDL Number | MFCD00059306 |
| SMILES | COC(=O)\C=C(/C)C(=O)OC |
| Synonym | Citraconic Acid Dimethyl Ester |
| IUPAC Name | 1,4-dimethyl (2E)-2-methylbut-2-enedioate |
| InChI Key | WQEXBUQDXKPVHR-SNAWJCMRSA-N |
| Molecular Formula | C7H10O4 |
Methyl 3-(4-Methoxycarbonylphenyl)propionate 97.0+%, TCI America™
CAS: 40912-11-6 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00059305 InChI Key: MLKXCCLYRPKSBM-UHFFFAOYSA-N Synonym: 3-(4-Carboxyphenyl)propionic Acid Dimethyl Ester, 3-(4-Methoxycarbonylphenyl)propionic Acid Methyl Ester PubChem CID: 595759 IUPAC Name: methyl 4-(3-methoxy-3-oxopropyl)benzoate SMILES: COC(=O)CCC1=CC=C(C=C1)C(=O)OC
| PubChem CID | 595759 |
|---|---|
| CAS | 40912-11-6 |
| Molecular Weight (g/mol) | 222.24 |
| MDL Number | MFCD00059305 |
| SMILES | COC(=O)CCC1=CC=C(C=C1)C(=O)OC |
| Synonym | 3-(4-Carboxyphenyl)propionic Acid Dimethyl Ester, 3-(4-Methoxycarbonylphenyl)propionic Acid Methyl Ester |
| IUPAC Name | methyl 4-(3-methoxy-3-oxopropyl)benzoate |
| InChI Key | MLKXCCLYRPKSBM-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |
Methyl 3,3-Dimethoxypropionate 98.0+%, TCI America™
CAS: 7424-91-1 Molecular Formula: C6H12O4 Molecular Weight (g/mol): 148.158 MDL Number: MFCD00010650 InChI Key: SMCVPMKCDDNUCQ-UHFFFAOYSA-N PubChem CID: 81924 IUPAC Name: methyl 3,3-dimethoxypropanoate SMILES: COC(CC(=O)OC)OC
| PubChem CID | 81924 |
|---|---|
| CAS | 7424-91-1 |
| Molecular Weight (g/mol) | 148.158 |
| MDL Number | MFCD00010650 |
| SMILES | COC(CC(=O)OC)OC |
| IUPAC Name | methyl 3,3-dimethoxypropanoate |
| InChI Key | SMCVPMKCDDNUCQ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O4 |
Methyl 2,6-Dichlorophenylacetate 98.0+%, TCI America™
CAS: 54551-83-6 Molecular Formula: C9H8Cl2O2 Molecular Weight (g/mol): 219.061 MDL Number: MFCD00191640 InChI Key: FCWRUYPZZJPCCG-UHFFFAOYSA-N PubChem CID: 2734107 IUPAC Name: methyl 2-(2,6-dichlorophenyl)acetate SMILES: COC(=O)CC1=C(C=CC=C1Cl)Cl
| PubChem CID | 2734107 |
|---|---|
| CAS | 54551-83-6 |
| Molecular Weight (g/mol) | 219.061 |
| MDL Number | MFCD00191640 |
| SMILES | COC(=O)CC1=C(C=CC=C1Cl)Cl |
| IUPAC Name | methyl 2-(2,6-dichlorophenyl)acetate |
| InChI Key | FCWRUYPZZJPCCG-UHFFFAOYSA-N |
| Molecular Formula | C9H8Cl2O2 |
Methyl 4-Bromocrotonate 80.0+%, TCI America™
CAS: 1117-71-1 Molecular Formula: C5H7BrO2 Molecular Weight (g/mol): 179.01 MDL Number: MFCD00000246,MFCD09998308 InChI Key: RWIKCBHOVNDESJ-NSCUHMNNSA-N Synonym: methyl 4-bromocrotonate,e-methyl 4-bromobut-2-enoate,4-bromocrotonic acid methyl ester,methyl gamma-bromocrotonate,methyl bromocrotonate,methyl 4-bromo-2-butenoate,2-butenoic acid, 4-bromo-, methyl ester,methyl 4-bromobut-2-enoate,methyl 2e-4-bromobut-2-enoate,crotonic acid, 4-bromo-, methyl ester PubChem CID: 5369175 IUPAC Name: methyl (2E)-4-bromobut-2-enoate SMILES: COC(=O)\C=C\CBr
| PubChem CID | 5369175 |
|---|---|
| CAS | 1117-71-1 |
| Molecular Weight (g/mol) | 179.01 |
| MDL Number | MFCD00000246,MFCD09998308 |
| SMILES | COC(=O)\C=C\CBr |
| Synonym | methyl 4-bromocrotonate,e-methyl 4-bromobut-2-enoate,4-bromocrotonic acid methyl ester,methyl gamma-bromocrotonate,methyl bromocrotonate,methyl 4-bromo-2-butenoate,2-butenoic acid, 4-bromo-, methyl ester,methyl 4-bromobut-2-enoate,methyl 2e-4-bromobut-2-enoate,crotonic acid, 4-bromo-, methyl ester |
| IUPAC Name | methyl (2E)-4-bromobut-2-enoate |
| InChI Key | RWIKCBHOVNDESJ-NSCUHMNNSA-N |
| Molecular Formula | C5H7BrO2 |
Dimethyl cis-4-Cyclohexene-1,2-dicarboxylate 97.0+%, TCI America™
CAS: 4841-84-3 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.218 MDL Number: MFCD00209581 InChI Key: DVVAGRMJGUQHLI-OCAPTIKFSA-N Synonym: dimethyl cis-4-cyclohexene-1,2-dicarboxylate,dimethyl cis-1,2,3,6-tetrahydrophthalate,cis-dimethyl cyclohex-4-ene-1,2-dicarboxylate,dimethylcis-4-cyclohexene-1,2-dicarboxylate,1r, 6s-methyl 6-methoxycarbonyl-3-cyclohexenecarboxylate,4-cyclohexene-1alpha,2alpha-dicarboxylic acid dimethyl ester,1,2-dimethyl 1r,2s-cyclohex-4-ene-1,2-dicarboxylate,4-cyclohexene-1,2-dicarboxylicacid, dimethyl ester, 1r,2s-rel PubChem CID: 10867283 IUPAC Name: dimethyl (1R,2S)-cyclohex-4-ene-1,2-dicarboxylate SMILES: COC(=O)C1CC=CCC1C(=O)OC
| PubChem CID | 10867283 |
|---|---|
| CAS | 4841-84-3 |
| Molecular Weight (g/mol) | 198.218 |
| MDL Number | MFCD00209581 |
| SMILES | COC(=O)C1CC=CCC1C(=O)OC |
| Synonym | dimethyl cis-4-cyclohexene-1,2-dicarboxylate,dimethyl cis-1,2,3,6-tetrahydrophthalate,cis-dimethyl cyclohex-4-ene-1,2-dicarboxylate,dimethylcis-4-cyclohexene-1,2-dicarboxylate,1r, 6s-methyl 6-methoxycarbonyl-3-cyclohexenecarboxylate,4-cyclohexene-1alpha,2alpha-dicarboxylic acid dimethyl ester,1,2-dimethyl 1r,2s-cyclohex-4-ene-1,2-dicarboxylate,4-cyclohexene-1,2-dicarboxylicacid, dimethyl ester, 1r,2s-rel |
| IUPAC Name | dimethyl (1R,2S)-cyclohex-4-ene-1,2-dicarboxylate |
| InChI Key | DVVAGRMJGUQHLI-OCAPTIKFSA-N |
| Molecular Formula | C10H14O4 |
Methyl 3-Bromopropionate 99.0+%, TCI America™
CAS: 3395-91-3 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.00 MDL Number: MFCD00000250 InChI Key: KQEVIFKPZOGBMZ-UHFFFAOYSA-N Synonym: methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester PubChem CID: 76934 IUPAC Name: methyl 3-bromopropanoate SMILES: COC(=O)CCBr
| PubChem CID | 76934 |
|---|---|
| CAS | 3395-91-3 |
| Molecular Weight (g/mol) | 167.00 |
| MDL Number | MFCD00000250 |
| SMILES | COC(=O)CCBr |
| Synonym | methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester |
| IUPAC Name | methyl 3-bromopropanoate |
| InChI Key | KQEVIFKPZOGBMZ-UHFFFAOYSA-N |
| Molecular Formula | C4H7BrO2 |
N-(9-Dimethylamino-1-oxononyl)-N-hydroxy-beta-alanine Methyl Ester 97.0+%, TCI America™
CAS: 1239468-48-4 Molecular Formula: C15H30N2O4 Molecular Weight (g/mol): 302.42 MDL Number: MFCD22375684 InChI Key: KDYRPQNFCURCQB-UHFFFAOYSA-N Synonym: NCDM-32b PubChem CID: 46901417 IUPAC Name: methyl 3-[9-(dimethylamino)-N-hydroxynonanamido]propanoate SMILES: COC(=O)CCN(O)C(=O)CCCCCCCCN(C)C
| PubChem CID | 46901417 |
|---|---|
| CAS | 1239468-48-4 |
| Molecular Weight (g/mol) | 302.42 |
| MDL Number | MFCD22375684 |
| SMILES | COC(=O)CCN(O)C(=O)CCCCCCCCN(C)C |
| Synonym | NCDM-32b |
| IUPAC Name | methyl 3-[9-(dimethylamino)-N-hydroxynonanamido]propanoate |
| InChI Key | KDYRPQNFCURCQB-UHFFFAOYSA-N |
| Molecular Formula | C15H30N2O4 |
1H,1H,2H,2H-Tridecafluoro-n-octyl Methacrylate (stabilized with HQ + MEHQ) 98.0+%, TCI America™
CAS: 2144-53-8 Molecular Formula: C12H9F13O2 Molecular Weight (g/mol): 432.18 MDL Number: MFCD00077580 InChI Key: CDXFIRXEAJABAZ-UHFFFAOYSA-N Synonym: Methacrylic Acid 1H,1H,2H,2H-Tridecafluoro-n-octyl Ester, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-n-octyl Methacrylate, Methacrylic Acid 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-n-octyl Ester PubChem CID: 75066 IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
| PubChem CID | 75066 |
|---|---|
| CAS | 2144-53-8 |
| Molecular Weight (g/mol) | 432.18 |
| MDL Number | MFCD00077580 |
| SMILES | CC(=C)C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
| Synonym | Methacrylic Acid 1H,1H,2H,2H-Tridecafluoro-n-octyl Ester, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-n-octyl Methacrylate, Methacrylic Acid 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-n-octyl Ester |
| IUPAC Name | 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl 2-methylprop-2-enoate |
| InChI Key | CDXFIRXEAJABAZ-UHFFFAOYSA-N |
| Molecular Formula | C12H9F13O2 |
Methyl 3-Methoxyisobutyrate 98.0+%, TCI America™
CAS: 3852-11-7 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00671553 InChI Key: LYLUAHKXJUQFDG-UHFFFAOYNA-N Synonym: 3-Methoxyisobutyric Acid Methyl Ester, Methyl 3-Methoxy-2-methylpropionate, 3-Methoxy-2-methylpropionic Acid Methyl Ester PubChem CID: 107177 IUPAC Name: methyl 3-methoxy-2-methylpropanoate SMILES: CC(COC)C(=O)OC
| PubChem CID | 107177 |
|---|---|
| CAS | 3852-11-7 |
| Molecular Weight (g/mol) | 132.16 |
| MDL Number | MFCD00671553 |
| SMILES | CC(COC)C(=O)OC |
| Synonym | 3-Methoxyisobutyric Acid Methyl Ester, Methyl 3-Methoxy-2-methylpropionate, 3-Methoxy-2-methylpropionic Acid Methyl Ester |
| IUPAC Name | methyl 3-methoxy-2-methylpropanoate |
| InChI Key | LYLUAHKXJUQFDG-UHFFFAOYNA-N |
| Molecular Formula | C6H12O3 |
3-Methyl-2(5H)-furanone 97.0+%, TCI America™
CAS: 22122-36-7 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.101 MDL Number: MFCD00191545 InChI Key: VGHBEMPMIVEGJP-UHFFFAOYSA-N Synonym: 4-Hydroxy-2-methyl-2-butenoic Acid gamma-Lactone PubChem CID: 30945 IUPAC Name: 4-methyl-2H-furan-5-one SMILES: CC1=CCOC1=O
| PubChem CID | 30945 |
|---|---|
| CAS | 22122-36-7 |
| Molecular Weight (g/mol) | 98.101 |
| MDL Number | MFCD00191545 |
| SMILES | CC1=CCOC1=O |
| Synonym | 4-Hydroxy-2-methyl-2-butenoic Acid gamma-Lactone |
| IUPAC Name | 4-methyl-2H-furan-5-one |
| InChI Key | VGHBEMPMIVEGJP-UHFFFAOYSA-N |
| Molecular Formula | C5H6O2 |
Methyl 5-Norbornene-2-carboxylate (endo- and exo- mixture) 96.0+%, TCI America™
CAS: 6203-08-3 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00167592 InChI Key: RMAZRAQKPTXZNL-UHFFFAOYNA-N Synonym: Bicyclo[2.2.1]hept-5-ene-2-carboxylic Acid Methyl Ester, Methyl Bicyclo[2.2.1]hept-5-ene-2-carboxylate, 5-Norbornene-2-carboxylic Acid Methyl Ester PubChem CID: 250075 IUPAC Name: methyl bicyclo[2.2.1]hept-2-ene-5-carboxylate SMILES: COC(=O)C1CC2CC1C=C2
| PubChem CID | 250075 |
|---|---|
| CAS | 6203-08-3 |
| Molecular Weight (g/mol) | 152.19 |
| MDL Number | MFCD00167592 |
| SMILES | COC(=O)C1CC2CC1C=C2 |
| Synonym | Bicyclo[2.2.1]hept-5-ene-2-carboxylic Acid Methyl Ester, Methyl Bicyclo[2.2.1]hept-5-ene-2-carboxylate, 5-Norbornene-2-carboxylic Acid Methyl Ester |
| IUPAC Name | methyl bicyclo[2.2.1]hept-2-ene-5-carboxylate |
| InChI Key | RMAZRAQKPTXZNL-UHFFFAOYNA-N |
| Molecular Formula | C9H12O2 |
Methyl L-(-)-Lactate 98.0+%, TCI America™
CAS: 27871-49-4 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00064265 InChI Key: LPEKGGXMPWTOCB-VKHMYHEASA-N Synonym: methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester PubChem CID: 94386 ChEBI: CHEBI:83222 IUPAC Name: methyl (2S)-2-hydroxypropanoate SMILES: COC(=O)[C@H](C)O
| PubChem CID | 94386 |
|---|---|
| CAS | 27871-49-4 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:83222 |
| MDL Number | MFCD00064265 |
| SMILES | COC(=O)[C@H](C)O |
| Synonym | methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester |
| IUPAC Name | methyl (2S)-2-hydroxypropanoate |
| InChI Key | LPEKGGXMPWTOCB-VKHMYHEASA-N |
| Molecular Formula | C4H8O3 |
tert-Butyl Crotonate 98.0+%, TCI America™
CAS: 79218-15-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00059055 InChI Key: QHSPZGZEUDEIQM-AATRIKPKSA-N Synonym: Crotonic Acid tert-Butyl Ester PubChem CID: 5463127 IUPAC Name: tert-butyl (E)-but-2-enoate SMILES: CC=CC(=O)OC(C)(C)C
| PubChem CID | 5463127 |
|---|---|
| CAS | 79218-15-8 |
| Molecular Weight (g/mol) | 142.198 |
| MDL Number | MFCD00059055 |
| SMILES | CC=CC(=O)OC(C)(C)C |
| Synonym | Crotonic Acid tert-Butyl Ester |
| IUPAC Name | tert-butyl (E)-but-2-enoate |
| InChI Key | QHSPZGZEUDEIQM-AATRIKPKSA-N |
| Molecular Formula | C8H14O2 |