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2-[(4-chlorophenyl)sulfanyl]acetic acid

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Compound number:	MolPort-000-002-482
CAS number:	3405-88-7
IUPAC:	2-[(4-chlorophenyl)sulfanyl]acetic acid
IUPAC traditional:	[(4-chlorophenyl)sulfanyl]acetic acid
SMILES:	OC(=O)CSc1ccc(Cl)cc1
InChI key:	YPKLXLYGMAWXDO-UHFFFAOYSA-N
Molecular formula:	C8H7ClO2S
Molecular weight:	202.65
Solubility:	soluble

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Compound Identifiers

Compound number:	MolPort-000-002-482
CAS number:	3405-88-7

Names, Synonyms and 3rd Party Identifiers

Name:	ZINC000000075397
	((4-chlorophenyl)thio)acetic acid
	(4-Chloro-phenylsulfanyl)-acetic acid
	(4-Chloro-phenylsulfanyl)-aceticacid
	(4-Chlorophenylthio) acetic acid
	(4-Chlorophenylthio)acetic acid
	(4-chlorophenyl)sulfanylacetic acid
	2-((4-Chlorophenyl)thio)acetic acid
	2-(4-chlorophenyl)thioacetic acid
	2-(4-chlorophenylthio)acetic acid
	CHLOROPHENYLTHIOACETICACID 4[]()-
	[(4-chlorophenyl)sulfanyl]acetic acid
	[(4-chlorophenyl)thio]acetic acid
	acetic acid, [(4-chlorophenyl)thio]-
	p-Chlorophenylthioacetic Acid
	MFCD00021762

InChI

InChI:	1S/C8H7ClO2S/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
InChI key:	YPKLXLYGMAWXDO-UHFFFAOYSA-N

Calculated Properties

Molecular formula:	C8H7ClO2S
Molecular weight:	202.65

Scaffolds

benzene

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2-[(4-chlorophenyl)sulfanyl]acetic acid

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