ethyl 2-sulfanylpropanoate; methylbenzene

Systemtic Name: ethyl 2-sulfanylpropanoate; methylbenzene Openeye Name: ethyl 2-sulfanylpropanoate; toluene CAS Name: 2-mercaptopropanoic acid ethyl ester; toluene IUPAC Name: ethyl 2-sulfanylpropanoate; toluene Traditional Name: 2-mercaptopropionic acid ethyl ester; toluene Formula: C12H18O2S MolecularWeight: 226.33512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8.C5H10O2S/c1-7-5-3-2-4-6-7;1-3-7-5(6)4(2)8/h2-6H,1H3;4,8H,3H2,1-2H3