Organic acids and derivatives
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Ethyl Trichloroacetate 97.0+%, TCI America™
CAS: 515-84-4 Molecular Formula: C4H5Cl3O2 Molecular Weight (g/mol): 191.43 MDL Number: MFCD00000795 InChI Key: SJMLNDPIJZBEKY-UHFFFAOYSA-N Synonym: ethyl trichloroacetate,acetic acid, trichloro-, ethyl ester,unii-br8fkn5z55,acetic acid, ester with trichloroethanol,ethyltrichloroacetate,br8fkn5z55,acetic acid, 2,2,2-trichloro-, ethyl ester,acmc-209kup,ethyl-2,2,2-trichloroacetate PubChem CID: 10588 IUPAC Name: ethyl 2,2,2-trichloroacetate SMILES: CCOC(=O)C(Cl)(Cl)Cl
| PubChem CID | 10588 |
|---|---|
| CAS | 515-84-4 |
| Molecular Weight (g/mol) | 191.43 |
| MDL Number | MFCD00000795 |
| SMILES | CCOC(=O)C(Cl)(Cl)Cl |
| Synonym | ethyl trichloroacetate,acetic acid, trichloro-, ethyl ester,unii-br8fkn5z55,acetic acid, ester with trichloroethanol,ethyltrichloroacetate,br8fkn5z55,acetic acid, 2,2,2-trichloro-, ethyl ester,acmc-209kup,ethyl-2,2,2-trichloroacetate |
| IUPAC Name | ethyl 2,2,2-trichloroacetate |
| InChI Key | SJMLNDPIJZBEKY-UHFFFAOYSA-N |
| Molecular Formula | C4H5Cl3O2 |
Ethyl 2-Chloropropionate 97.0+%, TCI America™
CAS: 535-13-7 Molecular Formula: C5H9ClO2 Molecular Weight (g/mol): 136.58 MDL Number: MFCD00000864 InChI Key: JEAVBVKAYUCPAQ-UHFFFAOYNA-N PubChem CID: 10807 IUPAC Name: ethyl 2-chloropropanoate SMILES: CCOC(=O)C(C)Cl
| PubChem CID | 10807 |
|---|---|
| CAS | 535-13-7 |
| Molecular Weight (g/mol) | 136.58 |
| MDL Number | MFCD00000864 |
| SMILES | CCOC(=O)C(C)Cl |
| IUPAC Name | ethyl 2-chloropropanoate |
| InChI Key | JEAVBVKAYUCPAQ-UHFFFAOYNA-N |
| Molecular Formula | C5H9ClO2 |
2-Ethoxyethyl Trichloroacetate 95.0+%, TCI America™
CAS: 30668-97-4 Molecular Formula: C6H9Cl3O3 Molecular Weight (g/mol): 235.49 MDL Number: MFCD00191691 InChI Key: LEGOWVFXOHMHKG-UHFFFAOYSA-N Synonym: Trichloroacetic Acid 2-Ethoxyethyl Ester, Ethylene Glycol Monoethyl Ether Trichloroacetate PubChem CID: 547792 IUPAC Name: 2-ethoxyethyl 2,2,2-trichloroacetate SMILES: CCOCCOC(=O)C(Cl)(Cl)Cl
| PubChem CID | 547792 |
|---|---|
| CAS | 30668-97-4 |
| Molecular Weight (g/mol) | 235.49 |
| MDL Number | MFCD00191691 |
| SMILES | CCOCCOC(=O)C(Cl)(Cl)Cl |
| Synonym | Trichloroacetic Acid 2-Ethoxyethyl Ester, Ethylene Glycol Monoethyl Ether Trichloroacetate |
| IUPAC Name | 2-ethoxyethyl 2,2,2-trichloroacetate |
| InChI Key | LEGOWVFXOHMHKG-UHFFFAOYSA-N |
| Molecular Formula | C6H9Cl3O3 |
2,3-Dibromopropionic Acid 97.0+%, TCI America™
CAS: 600-05-5 Molecular Formula: C3H4Br2O2 Molecular Weight (g/mol): 231.87 MDL Number: MFCD00004212 InChI Key: ZMYAKSMZTVWUJB-UHFFFAOYNA-N Synonym: 2,3-dibromopropionic acid,propanoic acid, 2,3-dibromo,alpha,beta-dibromopropionic acid,propionic acid, 2,3-dibromo,.alpha.,.beta.-dibromopropionic acid,acmc-209mhg,propanoic acid,3-dibromo,propionic acid,3-dibromo,2,3-dibromo-propionic acid,dsstox_cid_12832 PubChem CID: 11746 IUPAC Name: 2,3-dibromopropanoic acid SMILES: OC(=O)C(Br)CBr
| PubChem CID | 11746 |
|---|---|
| CAS | 600-05-5 |
| Molecular Weight (g/mol) | 231.87 |
| MDL Number | MFCD00004212 |
| SMILES | OC(=O)C(Br)CBr |
| Synonym | 2,3-dibromopropionic acid,propanoic acid, 2,3-dibromo,alpha,beta-dibromopropionic acid,propionic acid, 2,3-dibromo,.alpha.,.beta.-dibromopropionic acid,acmc-209mhg,propanoic acid,3-dibromo,propionic acid,3-dibromo,2,3-dibromo-propionic acid,dsstox_cid_12832 |
| IUPAC Name | 2,3-dibromopropanoic acid |
| InChI Key | ZMYAKSMZTVWUJB-UHFFFAOYNA-N |
| Molecular Formula | C3H4Br2O2 |
Isopropyl Chloroacetate 98.0+%, TCI America™
CAS: 105-48-6 Molecular Formula: C5H9ClO2 Molecular Weight (g/mol): 136.58 MDL Number: MFCD00040410 InChI Key: VODRWDBLLGYRJT-UHFFFAOYSA-N Synonym: isopropyl chloroacetate,chloroacetic acid isopropyl ester,acetic acid, chloro-, 1-methylethyl ester,iso-propyl chloroacetate,clch2c o och ch3 2,ccris 7748,acetic acid, chloro-, isopropyl ester,acetic acid, 2-chloro-, 1-methylethyl ester,chloroacetic acid, 1-methyl ester,monochloroacetic acid isopropyl ester PubChem CID: 7759 IUPAC Name: propan-2-yl 2-chloroacetate SMILES: CC(C)OC(=O)CCl
| PubChem CID | 7759 |
|---|---|
| CAS | 105-48-6 |
| Molecular Weight (g/mol) | 136.58 |
| MDL Number | MFCD00040410 |
| SMILES | CC(C)OC(=O)CCl |
| Synonym | isopropyl chloroacetate,chloroacetic acid isopropyl ester,acetic acid, chloro-, 1-methylethyl ester,iso-propyl chloroacetate,clch2c o och ch3 2,ccris 7748,acetic acid, chloro-, isopropyl ester,acetic acid, 2-chloro-, 1-methylethyl ester,chloroacetic acid, 1-methyl ester,monochloroacetic acid isopropyl ester |
| IUPAC Name | propan-2-yl 2-chloroacetate |
| InChI Key | VODRWDBLLGYRJT-UHFFFAOYSA-N |
| Molecular Formula | C5H9ClO2 |
alpha-Bromophenylacetic Acid 98.0+%, TCI America™
CAS: 4870-65-9 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00004206 InChI Key: WAKFRZBXTKUFIW-UHFFFAOYSA-N Synonym: alpha-bromophenylacetic acid,bromo phenyl acetic acid,.alpha.-bromophenylacetic acid,bromophenylacetic acid,bromo-phenyl-acetic acid,bromo-phenylacetic acid,dl-.alpha.-bromophenylacetic acid,benzeneacetic acid, .alpha.-bromo,phenylbromoacetic acid,bromo phenyl aceticacid PubChem CID: 97919 IUPAC Name: 2-bromo-2-phenylacetic acid SMILES: C1=CC=C(C=C1)C(C(=O)O)Br
| PubChem CID | 97919 |
|---|---|
| CAS | 4870-65-9 |
| Molecular Weight (g/mol) | 215.046 |
| MDL Number | MFCD00004206 |
| SMILES | C1=CC=C(C=C1)C(C(=O)O)Br |
| Synonym | alpha-bromophenylacetic acid,bromo phenyl acetic acid,.alpha.-bromophenylacetic acid,bromophenylacetic acid,bromo-phenyl-acetic acid,bromo-phenylacetic acid,dl-.alpha.-bromophenylacetic acid,benzeneacetic acid, .alpha.-bromo,phenylbromoacetic acid,bromo phenyl aceticacid |
| IUPAC Name | 2-bromo-2-phenylacetic acid |
| InChI Key | WAKFRZBXTKUFIW-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
3-Chloro-2,2,3,3-tetrafluoropropionic Acid 98.0+%, TCI America™
CAS: 661-82-5 Molecular Formula: C3HClF4O2 Molecular Weight (g/mol): 180.483 MDL Number: MFCD00153099 InChI Key: XJRMCFMZGRJXEZ-UHFFFAOYSA-N PubChem CID: 2782491 IUPAC Name: 3-chloro-2,2,3,3-tetrafluoropropanoic acid SMILES: C(=O)(C(C(F)(F)Cl)(F)F)O
| PubChem CID | 2782491 |
|---|---|
| CAS | 661-82-5 |
| Molecular Weight (g/mol) | 180.483 |
| MDL Number | MFCD00153099 |
| SMILES | C(=O)(C(C(F)(F)Cl)(F)F)O |
| IUPAC Name | 3-chloro-2,2,3,3-tetrafluoropropanoic acid |
| InChI Key | XJRMCFMZGRJXEZ-UHFFFAOYSA-N |
| Molecular Formula | C3HClF4O2 |
Methyl 2-Bromobutyrate 97.0+%, TCI America™
CAS: 3196-15-4 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.029 MDL Number: MFCD00009666 InChI Key: UFQQDNMQADCHGH-UHFFFAOYSA-N Synonym: methyl 2-bromobutyrate,2-bromobutyric acid methyl ester,butanoic acid, 2-bromo-, methyl ester,methyl-2-bromobutyrate,alpha-bromobutyric acid methyl ester,methyl bromobutyrate,methyl-2-bromobutanoate,pubchem20191,methylaethylbromessigester,methyl alpha-bromobutyrate PubChem CID: 95577 IUPAC Name: methyl 2-bromobutanoate SMILES: CCC(C(=O)OC)Br
| PubChem CID | 95577 |
|---|---|
| CAS | 3196-15-4 |
| Molecular Weight (g/mol) | 181.029 |
| MDL Number | MFCD00009666 |
| SMILES | CCC(C(=O)OC)Br |
| Synonym | methyl 2-bromobutyrate,2-bromobutyric acid methyl ester,butanoic acid, 2-bromo-, methyl ester,methyl-2-bromobutyrate,alpha-bromobutyric acid methyl ester,methyl bromobutyrate,methyl-2-bromobutanoate,pubchem20191,methylaethylbromessigester,methyl alpha-bromobutyrate |
| IUPAC Name | methyl 2-bromobutanoate |
| InChI Key | UFQQDNMQADCHGH-UHFFFAOYSA-N |
| Molecular Formula | C5H9BrO2 |
Tribromoacetic Acid 98.0+%, TCI America™
CAS: 75-96-7 Molecular Formula: C2HBr3O2 Molecular Weight (g/mol): 296.74 MDL Number: MFCD00004167 InChI Key: QIONYIKHPASLHO-UHFFFAOYSA-N Synonym: tribromoacetic acid,acetic acid, tribromo,tribromacetic acid,unii-71ktl99qjx,ccris 7887,71ktl99qjx,acetic acid, 2,2,2-tribromo,snpljqbkdvidtaetp@,dsstox_cid_1668,acmc-209p0y PubChem CID: 6415 IUPAC Name: 2,2,2-tribromoacetic acid SMILES: C(=O)(C(Br)(Br)Br)O
| PubChem CID | 6415 |
|---|---|
| CAS | 75-96-7 |
| Molecular Weight (g/mol) | 296.74 |
| MDL Number | MFCD00004167 |
| SMILES | C(=O)(C(Br)(Br)Br)O |
| Synonym | tribromoacetic acid,acetic acid, tribromo,tribromacetic acid,unii-71ktl99qjx,ccris 7887,71ktl99qjx,acetic acid, 2,2,2-tribromo,snpljqbkdvidtaetp@,dsstox_cid_1668,acmc-209p0y |
| IUPAC Name | 2,2,2-tribromoacetic acid |
| InChI Key | QIONYIKHPASLHO-UHFFFAOYSA-N |
| Molecular Formula | C2HBr3O2 |
(S)-(+)-2,2-Dimethylcyclopropanecarboxamide 98.0+%, TCI America™
CAS: 75885-58-4 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00216614 InChI Key: YBZQRYWKYBZZNT-UHFFFAOYNA-N Synonym: s-+-2,2-dimethylcyclopropanecarboxamide,s-2,2-dimethylcyclopropanecarboxamide,s-+-2,2-dimethylcyclopropane carboxamide,s-+-2,2,-dimethylcyclopropane carboxamide,s-r-+-2,2-dimethyl cyclopropane carboxamide,s-+-2,2-dimethylcyclo-propane carboxamide,1s-2,2-dimethylcyclopropanecarboxamide,1s-2,2-dimethylcyclopropane-1-carboxamide,cyclopropanecarboxamide, 2,2-dimethyl-, 1s,s-2,2-dimethyl-cyclopropanecarboxylic acid amide PubChem CID: 10197657 IUPAC Name: 2,2-dimethylcyclopropane-1-carboxamide SMILES: CC1(C)CC1C(N)=O
| PubChem CID | 10197657 |
|---|---|
| CAS | 75885-58-4 |
| Molecular Weight (g/mol) | 113.16 |
| MDL Number | MFCD00216614 |
| SMILES | CC1(C)CC1C(N)=O |
| Synonym | s-+-2,2-dimethylcyclopropanecarboxamide,s-2,2-dimethylcyclopropanecarboxamide,s-+-2,2-dimethylcyclopropane carboxamide,s-+-2,2,-dimethylcyclopropane carboxamide,s-r-+-2,2-dimethyl cyclopropane carboxamide,s-+-2,2-dimethylcyclo-propane carboxamide,1s-2,2-dimethylcyclopropanecarboxamide,1s-2,2-dimethylcyclopropane-1-carboxamide,cyclopropanecarboxamide, 2,2-dimethyl-, 1s,s-2,2-dimethyl-cyclopropanecarboxylic acid amide |
| IUPAC Name | 2,2-dimethylcyclopropane-1-carboxamide |
| InChI Key | YBZQRYWKYBZZNT-UHFFFAOYNA-N |
| Molecular Formula | C6H11NO |
Ethyl Cyclopropanecarboxylate 98.0+%, TCI America™
CAS: 4606-07-9 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00001282 InChI Key: LDDOSDVZPSGLFZ-UHFFFAOYSA-N Synonym: cyclopropanecarboxylic acid ethyl ester,ethyl cyclopropylcarboxylate,ethyl cyclopropane carboxylate,cyclopropanecarboxylic acid, ethyl ester,pubchem11840,ethyl cylopropylcarboxylate,ethoxycarbonyl cyclopropane,ethylcyclopropane carboxylate,ksc497s5p,lddosdvzpsglfz-uhfffaoysa PubChem CID: 78351 IUPAC Name: ethyl cyclopropanecarboxylate SMILES: CCOC(=O)C1CC1
| PubChem CID | 78351 |
|---|---|
| CAS | 4606-07-9 |
| Molecular Weight (g/mol) | 114.14 |
| MDL Number | MFCD00001282 |
| SMILES | CCOC(=O)C1CC1 |
| Synonym | cyclopropanecarboxylic acid ethyl ester,ethyl cyclopropylcarboxylate,ethyl cyclopropane carboxylate,cyclopropanecarboxylic acid, ethyl ester,pubchem11840,ethyl cylopropylcarboxylate,ethoxycarbonyl cyclopropane,ethylcyclopropane carboxylate,ksc497s5p,lddosdvzpsglfz-uhfffaoysa |
| IUPAC Name | ethyl cyclopropanecarboxylate |
| InChI Key | LDDOSDVZPSGLFZ-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
1,4-Phenylenediamine Sulfate 98.0+%, TCI America™
CAS: 16245-77-5 Molecular Formula: C6H10N2O4S Molecular Weight (g/mol): 206.22 MDL Number: MFCD00035510 InChI Key: UFPKLWVNKAMAPE-UHFFFAOYSA-N Synonym: p-phenylenediamine sulfate,benzene-1,4-diamine sulfate,1,4-diaminobenzene sulfate,1,4-phenylenediamine sulfate,1,4-benzenediamine, sulfate 1:1,unii-s7igm30961,benzene-1,4-diamine; sulfuric acid,1,4-benzenediamine, sulfate,benzene-1,4-diammonium sulphate,1,4-benzenediamine sulfate PubChem CID: 27769 IUPAC Name: benzene-1,4-diamine; sulfuric acid SMILES: OS(O)(=O)=O.NC1=CC=C(N)C=C1
| PubChem CID | 27769 |
|---|---|
| CAS | 16245-77-5 |
| Molecular Weight (g/mol) | 206.22 |
| MDL Number | MFCD00035510 |
| SMILES | OS(O)(=O)=O.NC1=CC=C(N)C=C1 |
| Synonym | p-phenylenediamine sulfate,benzene-1,4-diamine sulfate,1,4-diaminobenzene sulfate,1,4-phenylenediamine sulfate,1,4-benzenediamine, sulfate 1:1,unii-s7igm30961,benzene-1,4-diamine; sulfuric acid,1,4-benzenediamine, sulfate,benzene-1,4-diammonium sulphate,1,4-benzenediamine sulfate |
| IUPAC Name | benzene-1,4-diamine; sulfuric acid |
| InChI Key | UFPKLWVNKAMAPE-UHFFFAOYSA-N |
| Molecular Formula | C6H10N2O4S |
Diphenylamine Sulfate 98.0+%, TCI America™
CAS: 587-84-8 Molecular Formula: C12H13NO4S Molecular Weight (g/mol): 267.30 MDL Number: MFCD00042016 InChI Key: IPZMDJYHJNHGML-UHFFFAOYSA-N Synonym: diphenylamine sulfate,benzenamine, n-phenyl-, sulfate 1:1,usaf ek-743,n-phenylaniline; sulfuric acid,diphenylamine, hydrogen sulfate,diphenylammonium hydrogen sulphate,diphenylamine; sulfuric acid,diphenylaminesulfate,bis n-phenylanilinium sulphate,diphenylaminsulfat PubChem CID: 11486 IUPAC Name: N-phenylaniline; sulfuric acid SMILES: OS(O)(=O)=O.N(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 11486 |
|---|---|
| CAS | 587-84-8 |
| Molecular Weight (g/mol) | 267.30 |
| MDL Number | MFCD00042016 |
| SMILES | OS(O)(=O)=O.N(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | diphenylamine sulfate,benzenamine, n-phenyl-, sulfate 1:1,usaf ek-743,n-phenylaniline; sulfuric acid,diphenylamine, hydrogen sulfate,diphenylammonium hydrogen sulphate,diphenylamine; sulfuric acid,diphenylaminesulfate,bis n-phenylanilinium sulphate,diphenylaminsulfat |
| IUPAC Name | N-phenylaniline; sulfuric acid |
| InChI Key | IPZMDJYHJNHGML-UHFFFAOYSA-N |
| Molecular Formula | C12H13NO4S |
3-Aminopyrazole-4-carboxamide Hemisulfate 98.0+%, TCI America™
CAS: 27511-79-1 Molecular Formula: C8H14N8O6S Molecular Weight (g/mol): 350.31 MDL Number: MFCD00013093 InChI Key: UMPKASYMNORSRO-UHFFFAOYSA-N Synonym: 3-amino-4-pyrazolecarboxamide hemisulfate,5-aminopyrazole-4-carboxamide hemisulphate,3-amino-1h-pyrazole-4-carboxamide hemisulfate,1h-pyrazole-4-carboxamide, 3-amino-, sulfate 2:1,3-amino-4-pyrazolecarboxamide hemisulfate salt,3-aminopyrazole-4-carboxamide hemisulfate,5-amino-1h-pyrazole-4-carboxamide; sulfuric acid,bis 3-amino-1h-pyrazole-4-carboxamide ; sulfuric acid,bis 3-amino-2h-pyrazole-4-carboxamide ; sulfuric acid,5-amino-1h-pyrazole-4-carboxamide hemisulphate PubChem CID: 2723907 IUPAC Name: 5-amino-1H-pyrazole-4-carboxamide;sulfuric acid SMILES: C1=NNC(=C1C(=O)N)N.C1=NNC(=C1C(=O)N)N.OS(=O)(=O)O
| PubChem CID | 2723907 |
|---|---|
| CAS | 27511-79-1 |
| Molecular Weight (g/mol) | 350.31 |
| MDL Number | MFCD00013093 |
| SMILES | C1=NNC(=C1C(=O)N)N.C1=NNC(=C1C(=O)N)N.OS(=O)(=O)O |
| Synonym | 3-amino-4-pyrazolecarboxamide hemisulfate,5-aminopyrazole-4-carboxamide hemisulphate,3-amino-1h-pyrazole-4-carboxamide hemisulfate,1h-pyrazole-4-carboxamide, 3-amino-, sulfate 2:1,3-amino-4-pyrazolecarboxamide hemisulfate salt,3-aminopyrazole-4-carboxamide hemisulfate,5-amino-1h-pyrazole-4-carboxamide; sulfuric acid,bis 3-amino-1h-pyrazole-4-carboxamide ; sulfuric acid,bis 3-amino-2h-pyrazole-4-carboxamide ; sulfuric acid,5-amino-1h-pyrazole-4-carboxamide hemisulphate |
| IUPAC Name | 5-amino-1H-pyrazole-4-carboxamide;sulfuric acid |
| InChI Key | UMPKASYMNORSRO-UHFFFAOYSA-N |
| Molecular Formula | C8H14N8O6S |
Sodium Methyl Sulfate 98.0+%, TCI America™
CAS: 512-42-5 Molecular Formula: CH3NaO4S Molecular Weight (g/mol): 134.08 MDL Number: MFCD00013457 InChI Key: DZXBHDRHRFLQCJ-UHFFFAOYSA-M Synonym: sodium methyl sulfate,methylsulfuric acid sodium salt,methyl sodium sulfate,sodium methyl sulphate,sodium monomethylsulfate,unii-38w76yj3jn,sodium methylsulfate,methyl sulfate sodium salt,methyl sulfate, sodium salt,sulfuric acid, monomethyl ester, sodium salt PubChem CID: 2735086 IUPAC Name: sodium methyl sulfate SMILES: [Na+].COS([O-])(=O)=O
| PubChem CID | 2735086 |
|---|---|
| CAS | 512-42-5 |
| Molecular Weight (g/mol) | 134.08 |
| MDL Number | MFCD00013457 |
| SMILES | [Na+].COS([O-])(=O)=O |
| Synonym | sodium methyl sulfate,methylsulfuric acid sodium salt,methyl sodium sulfate,sodium methyl sulphate,sodium monomethylsulfate,unii-38w76yj3jn,sodium methylsulfate,methyl sulfate sodium salt,methyl sulfate, sodium salt,sulfuric acid, monomethyl ester, sodium salt |
| IUPAC Name | sodium methyl sulfate |
| InChI Key | DZXBHDRHRFLQCJ-UHFFFAOYSA-M |
| Molecular Formula | CH3NaO4S |