Benzoic acid, 2-cyano-, methyl ester
CAS Registry Number®
6587-24-2
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CAS Name
Benzoic acid, 2-cyano-, methyl esterMolecular Formula
C9H7NO2Molecular Mass
161.16Cite this Page
Benzoic acid, 2-cyano-, methyl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=6587-24-2 (retrieved ) (CAS RN: 6587-24-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
147 °C @ Press: 11 TorrMelting Point (1)
50-51 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C9H7NO2/c1-12-9(11)8-5-3-2-4-7(8)6-10/h2-5H,1H3
InChIKey
InChIKey=RAMPDACRJWTXEV-UHFFFAOYSA-N
SMILES
C(OC)(=O)C1=C(C#N)C=CC=C1
Canonical SMILES
N#CC=1C=CC=CC1C(=O)OC
Other Names for this Substance
- Benzoic acid, 2-cyano-, methyl ester
- Benzoic acid, o-cyano-, methyl ester
- Methyl o-cyanobenzoate
- Methyl 2-cyanobenzoate
- 2-Cyanobenzoic acid methyl ester
