2-Thiophenecarboxylic acid, 3-amino-5-(4-nitrophenyl)-, methyl ester

CAS Registry Number®

91076-99-2
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CAS Name

2-Thiophenecarboxylic acid, 3-amino-5-(4-nitrophenyl)-, methyl ester

Molecular Formula

C12H10N2O4S

Molecular Mass

278.28

Cite this Page

2-Thiophenecarboxylic acid, 3-amino-5-(4-nitrophenyl)-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=91076-99-2 (retrieved 2024-08-28) (CAS RN: 91076-99-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    219-220 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H10N2O4S/c1-18-12(15)11-9(13)6-10(19-11)7-2-4-8(5-3-7)14(16)17/h2-6H,13H2,1H3

InChIKey

InChIKey=NVUFFVPGEHZJFW-UHFFFAOYSA-N

SMILES

C(OC)(=O)C=1SC(=CC1N)C2=CC=C(N(=O)=O)C=C2

Canonical SMILES

O=C(OC)C=1SC(=CC1N)C=2C=CC(=CC2)N(=O)=O

Other Names for this Substance

  • 2-Thiophenecarboxylic acid, 3-amino-5-(4-nitrophenyl)-, methyl ester
  • Methyl 3-Amino-5-(4-nitrophenyl)thiophene-2-carboxylate