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2-(2,5-dimethylphenyl)sulfanylethanoic acid

2-(2,5-dimethylphenyl)sulfanylethanoic acid

Systemtic Name:2-(2,5-dimethylphenyl)sulfanylethanoic acid
Openeye Name:2-(2,5-dimethylphenyl)sulfanylacetic acid
CAS Name:2-[(2,5-dimethylphenyl)thio]acetic acid
IUPAC Name:2-(2,5-dimethylphenyl)sulfanylacetic acid
Traditional Name:2-[(2,5-dimethylphenyl)thio]acetic acid
Formula: C10H12O2S
MolecularWeight: 196.26608
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)O


Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)O


InChI

InChI=1S/C10H12O2S/c1-7-3-4-8(2)9(5-7)13-6-10(11)12/h3-5H,6H2,1-2H3,(H,11,12)


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