Methyl 3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoate

CAS Registry Number®

1002535-22-9
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CAS Name

Methyl 3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoate

Molecular Formula

C12H10ClN3O4

Molecular Mass

295.68

Cite this Page

Methyl 3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1002535-22-9 (retrieved 2024-08-26) (CAS RN: 1002535-22-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H10ClN3O4/c1-20-12(17)9-4-2-3-8(5-9)6-15-7-10(13)11(14-15)16(18)19/h2-5,7H,6H2,1H3

InChIKey

InChIKey=BAAFVWNLIUBTNG-UHFFFAOYSA-N

SMILES

C(N1N=C(N(=O)=O)C(Cl)=C1)C2=CC(C(OC)=O)=CC=C2

Canonical SMILES

O=C(OC)C1=CC=CC(=C1)CN2N=C(C(Cl)=C2)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-, methyl ester
  • Methyl 3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoate