Tibric acid

2-chloro-5-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonylbenzoic acid

CAS: 37087-94-8

Molecular Formula	`C14H18ClNO4S`
Molecular Weight	331.8 g/mol
LogP	2.9
Topological Polar Surface Area	83.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	331.0645
Heavy Atoms	21
Complexity	480.0

Chemical Identifiers

CAS Number	37087-94-8
SMILES	`CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O)C`
InChIKey	`IFXSWTIWFGIXQO-AOOOYVTPSA-N`

📖 Product Overview

Tibric acid (CAS: 37087-94-8) is a chemical compound with molecular formula C14H18ClNO4S and molecular weight 331.8 g/mol. Its IUPAC systematic name is 2-chloro-5-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonylbenzoic acid. LogP 2.9 Topological Polar Surface Area 83.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 331.0645 Heavy Atoms 21 Complexity 480.0 InChI Key: IFXSWTIWFGIXQO-AOOOYVTPSA-N. SMILES: CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O)C.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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