5-[(4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furancarboxylic acid

CAS Registry Number®

512809-85-7

CAS Name

5-[(4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furancarboxylic acid

Molecular Formula

C9H6BrN3O5

Molecular Mass

316.07

Cite this Page

5-[(4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furancarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=512809-85-7 (retrieved 2024-12-22) (CAS RN: 512809-85-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6BrN3O5/c10-6-4-12(11-8(6)13(16)17)3-5-1-2-7(18-5)9(14)15/h1-2,4H,3H2,(H,14,15)

InChIKey

InChIKey=RLWQKLOXFLKEPV-UHFFFAOYSA-N

SMILES

C(N1N=C(N(=O)=O)C(Br)=C1)C=2OC(C(O)=O)=CC2

Canonical SMILES

O=C(O)C=1OC(=CC1)CN2N=C(C(Br)=C2)N(=O)=O

Other Names for this Substance

  • 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-
  • 5-[(4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furancarboxylic acid

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