1-chloranyl-3-methyl-benzene; 2-sulfanylethanoic acid

Systemtic Name: 1-chloranyl-3-methyl-benzene; 2-sulfanylethanoic acid Openeye Name: 1-chloro-3-methyl-benzene; 2-sulfanylacetic acid CAS Name: 1-chloro-3-methylbenzene; 2-mercaptoacetic acid IUPAC Name: 1-chloro-3-methylbenzene; 2-sulfanylacetic acid Traditional Name: 1-chloro-3-methyl-benzene; 2-mercaptoacetic acid Formula: C9H11ClO2S MolecularWeight: 218.70044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)Cl.C(C(=O)O)S

Isomeric SMILES

CC1=CC(=CC=C1)Cl.C(C(=O)O)S

InChI

InChI=1S/C7H7Cl.C2H4O2S/c1-6-3-2-4-7(8)5-6;3-2(4)1-5/h2-5H,1H3;5H,1H2,(H,3,4)