Benzoic acid, 4-(cyanomethyl)-, methyl ester
CAS Registry Number®
76469-88-0
No image available.
CAS Name
Benzoic acid, 4-(cyanomethyl)-, methyl esterMolecular Formula
C10H9NO2Molecular Mass
175.18Cite this Page
Benzoic acid, 4-(cyanomethyl)-, methyl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=76469-88-0 (retrieved ) (CAS RN: 76469-88-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
150-155 °C @ Press: 0.5 TorrMelting Point (1)
60 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C10H9NO2/c1-13-10(12)9-4-2-8(3-5-9)6-7-11/h2-5H,6H2,1H3
InChIKey
InChIKey=XRZGMNGGCZTNGE-UHFFFAOYSA-N
SMILES
C(OC)(=O)C1=CC=C(CC#N)C=C1
Canonical SMILES
N#CCC1=CC=C(C=C1)C(=O)OC
Other Names for this Substance
- Benzoic acid, 4-(cyanomethyl)-, methyl ester
- p-Toluic acid, α-cyano-, methyl ester
- Methyl 4-cyanomethylbenzoate
- Methyl p-(cyanomethyl)benzoate
- Methyl α-cyano-p-toluate
