4-Chloro-β-methyl-3-nitro-γ-oxobenzenebutanoic acid
CAS Registry Number®
85633-96-1
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CAS Name
4-Chloro-β-methyl-3-nitro-γ-oxobenzenebutanoic acidMolecular Formula
C11H10ClNO5Molecular Mass
271.65Cite this Page
4-Chloro-β-methyl-3-nitro-γ-oxobenzenebutanoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=85633-96-1 (retrieved ) (CAS RN: 85633-96-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C11H10ClNO5/c1-6(4-10(14)15)11(16)7-2-3-8(12)9(5-7)13(17)18/h2-3,5-6H,4H2,1H3,(H,14,15)
InChIKey
InChIKey=ZDGKTISONWFCDF-UHFFFAOYSA-N
SMILES
C(C(CC(O)=O)C)(=O)C1=CC(N(=O)=O)=C(Cl)C=C1
Canonical SMILES
O=C(O)CC(C(=O)C1=CC=C(Cl)C(=C1)N(=O)=O)C
Other Names for this Substance
- Benzenebutanoic acid, 4-chloro-β-methyl-3-nitro-γ-oxo-
- 4-Chloro-β-methyl-3-nitro-γ-oxobenzenebutanoic acid
- 4-(4-Chloro-3-nitrophenyl)-3-methyl-4-oxobutanoic acid
- 3-Methyl-4-oxo-4-(3′-nitro-4′-chloro-phenyl)-butyric acid
Deleted or Replaced CAS Registry Numbers
151870-04-1
