Benzoic acid, 4-amino-2-methoxy-5-thiocyanato-, methyl ester

CAS Registry Number®

59168-56-8
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CAS Name

Benzoic acid, 4-amino-2-methoxy-5-thiocyanato-, methyl ester

Molecular Formula

C10H10N2O3S

Molecular Mass

238.26

Cite this Page

Benzoic acid, 4-amino-2-methoxy-5-thiocyanato-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59168-56-8 (retrieved 2024-06-30) (CAS RN: 59168-56-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H10N2O3S/c1-14-8-4-7(12)9(16-5-11)3-6(8)10(13)15-2/h3-4H,12H2,1-2H3

InChIKey

InChIKey=IRGMWPMUTWZIIJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CSC1=CC(C(=O)OC)=C(OC)C=C1N

Other Names for this Substance

  • Benzoic acid, 4-amino-2-methoxy-5-thiocyanato-, methyl ester
  • Methyl 4-amino-2-methoxy-5-thiocyanatobenzoate
  • 4-Amino-5-(cyanosulfanyl)-2-methoxybenzoic acid methyl ester