o-((2,3-Xylyl)thio)benzoic acid

2-(2,3-dimethylphenyl)sulfanylbenzoic acid

CAS: 58844-67-0

Molecular Formula	`C15H14O2S`
Molecular Weight	258.3 g/mol
LogP	5.1
Topological Polar Surface Area	62.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	258.07144
Heavy Atoms	18
Complexity	292.0

Chemical Identifiers

CAS Number	58844-67-0
SMILES	`CC1=C(C(=CC=C1)SC2=CC=CC=C2C(=O)O)C`
InChIKey	`IUHMFGGYIMDALM-UHFFFAOYSA-N`

📖 Product Overview

o-((2,3-Xylyl)thio)benzoic acid (CAS: 58844-67-0) is a chemical compound with molecular formula C15H14O2S and molecular weight 258.3 g/mol. Its IUPAC systematic name is 2-(2,3-dimethylphenyl)sulfanylbenzoic acid. LogP 5.1 Topological Polar Surface Area 62.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 258.07144 Heavy Atoms 18 Complexity 292.0 InChI Key: IUHMFGGYIMDALM-UHFFFAOYSA-N. SMILES: CC1=C(C(=CC=C1)SC2=CC=CC=C2C(=O)O)C.

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