Ethyl 2-methyl-3-nitrobenzoate
CAS Registry Number®
59382-60-4
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CAS Name
Ethyl 2-methyl-3-nitrobenzoateMolecular Formula
C10H11NO4Molecular Mass
209.20Cite this Page
Ethyl 2-methyl-3-nitrobenzoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=59382-60-4 (retrieved ) (CAS RN: 59382-60-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
112-114 °C @ Press: 0.3 TorrMelting Point (2)
37-38 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Reddy, Gondi Sudershan; ChemRxiv, (2020), 1-8, CAplus
Other Names and Identifiers
InChI
InChI=1S/C10H11NO4/c1-3-15-10(12)8-5-4-6-9(7(8)2)11(13)14/h4-6H,3H2,1-2H3
InChIKey
InChIKey=XINYBVBBEWUEPZ-UHFFFAOYSA-N
SMILES
C(OCC)(=O)C1=C(C)C(N(=O)=O)=CC=C1
Canonical SMILES
O=C(OCC)C1=CC=CC(=C1C)N(=O)=O
Other Names for this Substance
- Benzoic acid, 2-methyl-3-nitro-, ethyl ester
- o-Toluic acid, 3-nitro-, ethyl ester
- Ethyl 2-methyl-3-nitrobenzoate
- 2-Methyl-3-nitro-benzoic acid ethyl ester
