BRN 0496380

3-[(2-chlorophenyl)-ethylsulfanylmethyl]-1-methylindole-2-carboxylic acid

CAS: 56297-58-6

Molecular Formula	`C19H18ClNO2S`
Molecular Weight	359.9 g/mol
LogP	5.0
Topological Polar Surface Area	67.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	359.07468
Heavy Atoms	24
Complexity	449.0

Chemical Identifiers

CAS Number	56297-58-6
SMILES	`CCSC(C1=CC=CC=C1Cl)C2=C(N(C3=CC=CC=C32)C)C(=O)O`
InChIKey	`VYUYTWRZNURHBU-UHFFFAOYSA-N`

📖 Product Overview

BRN 0496380 (CAS: 56297-58-6) is a chemical compound with molecular formula C19H18ClNO2S and molecular weight 359.9 g/mol. Its IUPAC systematic name is 3-[(2-chlorophenyl)-ethylsulfanylmethyl]-1-methylindole-2-carboxylic acid. LogP 5.0 Topological Polar Surface Area 67.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 359.07468 Heavy Atoms 24 Complexity 449.0 InChI Key: VYUYTWRZNURHBU-UHFFFAOYSA-N. SMILES: CCSC(C1=CC=CC=C1Cl)C2=C(N(C3=CC=CC=C32)C)C(=O)O.

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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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