Benzoic acid, 5-methyl-2-nitro-, methyl ester
CAS Registry Number®
20587-30-8
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CAS Name
Benzoic acid, 5-methyl-2-nitro-, methyl esterMolecular Formula
C9H9NO4Molecular Mass
195.17Cite this Page
Benzoic acid, 5-methyl-2-nitro-, methyl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=20587-30-8 (retrieved ) (CAS RN: 20587-30-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
78-79 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C9H9NO4/c1-6-3-4-8(10(12)13)7(5-6)9(11)14-2/h3-5H,1-2H3
InChIKey
InChIKey=KFOICDVZQKFCGM-UHFFFAOYSA-N
SMILES
C(OC)(=O)C1=C(N(=O)=O)C=CC(C)=C1
Canonical SMILES
O=C(OC)C1=CC(=CC=C1N(=O)=O)C
Other Names for this Substance
- Benzoic acid, 5-methyl-2-nitro-, methyl ester
- m-Toluic acid, 6-nitro-, methyl ester
- Methyl 6-nitro-m-toluate
- Methyl 5-methyl-2-nitrobenzoate
- 5-Methyl-2-nitrobenzoic acid methyl ester
