{[(4-Hydroxy-3-methoxyphenyl)methyl]sulfanyl}acetic acid structure

{[(4-Hydroxy-3-methoxyphenyl)methyl]sulfanyl}acetic acid

2-[(4-hydroxy-3-methoxyphenyl)methylsulfanyl]acetic acid

Also Known As: {[(4-Hydroxy-3-methoxyphenyl)methyl]sulfanyl}acetic acid|2-[(4-hydroxy-3-methoxyphenyl)methylsulfanyl]acetic acid

CAS: 91062-05-4
Molecular Formula C10H12O4S
Molecular Weight 228.04562 g/mol
LogP 0.9
Topological Polar Surface Area 92.1 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 228.04562
Monoisotopic Mass 228.04562
Heavy Atoms 15
Complexity 210.0

Chemical Identifiers

CAS Number 91062-05-4
SMILES COC1=C(C=CC(=C1)CSCC(=O)O)O
InChIKey WDJGNQPPSDPTNE-UHFFFAOYSA-N

Product Overview

{[(4-Hydroxy-3-methoxyphenyl)methyl]sulfanyl}acetic acid (CAS 91062-05-4), with molecular formula C10H12O4S and molecular weight 228.04562 g/mol. IUPAC: 2-[(4-hydroxy-3-methoxyphenyl)methylsulfanyl]acetic acid.

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