3-Chloro-4-(isopropylsulfonyl)thiophene-2-carboxylic acid

Base Information

• Chemical Name: 3-Chloro-4-(isopropylsulfonyl)thiophene-2-carboxylic acid
• CAS No.: 175202-26-3
• Molecular Formula: C8H9ClO4S2
• Molecular Weight: 268.73800
• Hs Code.: 2934999090
• European Community (EC) Number: 692-303-5
• DSSTox Substance ID: DTXSID40384836
• Wikidata: Q82177216
• Mol file: 175202-26-3.mol

Synonyms:175202-26-3;3-CHLORO-4-(ISOPROPYLSULFONYL)THIOPHENE-2-CARBOXYLIC ACID;3-chloro-4-(propane-2-sulfonyl)thiophene-2-carboxylic acid;3-chloro-4-propan-2-ylsulfonylthiophene-2-carboxylic acid;3-Chloro-4-(propane-2-sulfonyl)-thiophene-2-carboxylic acid;3-CHLORO-4-(ISOPROPYLSULFONYL)THIOPHENE-2-CARBOXYLICACID;SCHEMBL1326886;DTXSID40384836;YBTCUNQIEVRDNE-UHFFFAOYSA-N;MFCD00084961;AKOS022181866;AS-5334;CS-0320809;3-chloro-4-(propane-2-sulphonyl)-thiophene-2-carboxylic acid

Chemical Property of 3-Chloro-4-(isopropylsulfonyl)thiophene-2-carboxylic acid

Chemical Property:

• PSA: 108.06000
• LogP: 3.36260
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 267.9630788
• Heavy Atom Count: 15
• Complexity: 346

Purity/Quality:

97% ^*data from raw suppliers

3-Chloro-4-(propane-2-sulfonyl)thiophene-2-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)S(=O)(=O)C1=CSC(=C1Cl)C(=O)O