2,4-Dimethyl 5-isothiocyanato-3-methyl-2,4-thiophenedicarboxylate

CAS Registry Number®

956576-59-3
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CAS Name

2,4-Dimethyl 5-isothiocyanato-3-methyl-2,4-thiophenedicarboxylate

Molecular Formula

C10H9NO4S2

Molecular Mass

271.31

Cite this Page

2,4-Dimethyl 5-isothiocyanato-3-methyl-2,4-thiophenedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=956576-59-3 (retrieved 2024-07-31) (CAS RN: 956576-59-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H9NO4S2/c1-5-6(9(12)14-2)8(11-4-16)17-7(5)10(13)15-3/h1-3H3

InChIKey

InChIKey=QAIHQRCRVSQBDA-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=C(N=C=S)SC(C(OC)=O)=C1C

Canonical SMILES

O=C(OC)C=1SC(N=C=S)=C(C(=O)OC)C1C

Other Names for this Substance

  • 2,4-Thiophenedicarboxylic acid, 5-isothiocyanato-3-methyl-, 2,4-dimethyl ester
  • 2,4-Dimethyl 5-isothiocyanato-3-methyl-2,4-thiophenedicarboxylate