3,5-Dinitrobenzenepropanoic acid
CAS Registry Number®
42287-92-3
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CAS Name
3,5-Dinitrobenzenepropanoic acidMolecular Formula
C9H8N2O6Molecular Mass
240.17Cite this Page
3,5-Dinitrobenzenepropanoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=42287-92-3 (retrieved ) (CAS RN: 42287-92-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C9H8N2O6/c12-9(13)2-1-6-3-7(10(14)15)5-8(4-6)11(16)17/h3-5H,1-2H2,(H,12,13)
InChIKey
InChIKey=KYBGWGFVJJRIMR-UHFFFAOYSA-N
SMILES
C(CC(O)=O)C1=CC(N(=O)=O)=CC(N(=O)=O)=C1
Canonical SMILES
O=C(O)CCC=1C=C(C=C(C1)N(=O)=O)N(=O)=O
Other Names for this Substance
- Benzenepropanoic acid, 3,5-dinitro-
- 3,5-Dinitrobenzenepropanoic acid
- 3,5-Dinitrohydrocinnamic acid