3-Chloro-4-(isopropylsulfonyl)-5-(methylthio)thiophene-2-carboxylic acid
3-chloro-5-methylsulfanyl-4-propan-2-ylsulfonylthiophene-2-carboxylic acid
Also Known As: Maybridge1_004699|3-chloro-4-(isopropylsulfonyl)-5-(methylthio)thiophene-2-carboxylic acid|HMS554N13|3-Chloro-4-(isopropylsulfonyl)-5-(methylthio)-thiophene-2-carboxylic acid|3-chloro-5-methylsulfanyl-4-propan-2-ylsulfonylthiophene-2-carboxylic acid|2-Thiophenecarboxylic acid, 3-chloro-4-[(1-methylethyl)sulfonyl]-5-(methylthio)-|I14-35107|3-chloro-5-(methylsulfanyl)-4-(propane-2-sulfonyl)thiophene-2-carboxylic acid|2-Thiophenecarboxylicacid, 3-chloro-4-[(1-methylethyl)sulfonyl]-5-(methylthio)-|Ethyl enediaminetetraacetic acid tripotassium salt dihydrate|3-Chloro-4-(Isopropylsulfonyl)-5-(Methylthio)Thiophene-2-CarboxylicAcid|3-Chloro-4-(isopropylsulfonyl)-5-(methylthio)thiophene-2carboxylic acid|3-chloro-4-(isopropylsulphonyl)-5-(methylthio)thiophene-2-carboxylic acid|3-chloro-4-isopropylsulfonyl-5-methylsulfanyl-thiophene-2-carboxylic acid
| Molecular Formula | C9H11ClO4S3 |
|---|---|
| Molecular Weight | 313.9508 g/mol |
| LogP | 3.0037 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.9508 |
| Monoisotopic Mass | 313.9508 |
| Heavy Atoms | 17 |
| Complexity | 544.83234 |
Chemical Identifiers
| CAS Number | 175202-23-0 |
|---|---|
| SMILES | CC(C)S(=O)(=O)C1=C(SC(=C1Cl)C(=O)O)SC |
Product Overview
3-Chloro-4-(isopropylsulfonyl)-5-(methylthio)thiophene-2-carboxylic acid (CAS 175202-23-0), with molecular formula C9H11ClO4S3 and molecular weight 313.9508 g/mol. IUPAC: 3-chloro-5-methylsulfanyl-4-propan-2-ylsulfonylthiophene-2-carboxylic acid.