2-Thiophenecarboxylic acid, 3-(isocyanatosulfonyl)-, methyl ester

CAS Registry Number®

79277-18-2

CAS Name

2-Thiophenecarboxylic acid, 3-(isocyanatosulfonyl)-, methyl ester

Molecular Formula

C7H5NO5S2

Molecular Mass

247.25

Cite this Page

2-Thiophenecarboxylic acid, 3-(isocyanatosulfonyl)-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79277-18-2 (retrieved 2024-11-08) (CAS RN: 79277-18-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H5NO5S2/c1-13-7(10)6-5(2-3-14-6)15(11,12)8-4-9/h2-3H,1H3

InChIKey

InChIKey=VJQINSVXSJNRLA-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C=NS(=O)(=O)C=1C=CSC1C(=O)OC

Other Names for this Substance

  • 2-Thiophenecarboxylic acid, 3-(isocyanatosulfonyl)-, methyl ester
  • Methyl 3-(isocyanatosulfonyl)thiophene-2-carboxylate

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