3-(Hydroxymethyl)benzonitrile
CAS Registry Number®
874-97-5
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CAS Name
3-(Hydroxymethyl)benzonitrileMolecular Formula
C8H7NOMolecular Mass
133.15Cite this Page
3-(Hydroxymethyl)benzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=874-97-5 (retrieved ) (CAS RN: 874-97-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
109-110 °C @ Press: 0.1 TorrMelting Point (2)
25-30 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Lee, Jaeyoung; Journal of Organic Chemistry, (2012), 77(10), 4821-4825, CAplus
Other Names and Identifiers
InChI
InChI=1S/C8H7NO/c9-5-7-2-1-3-8(4-7)6-10/h1-4,10H,6H2
InChIKey
InChIKey=PCOFIIVWHXIDGT-UHFFFAOYSA-N
SMILES
C(#N)C1=CC(CO)=CC=C1
Canonical SMILES
N#CC1=CC=CC(=C1)CO
Other Names for this Substance
- Benzonitrile, 3-(hydroxymethyl)-
- m-Tolunitrile, α-hydroxy-
- 3-(Hydroxymethyl)benzonitrile
- m-Cyanobenzyl alcohol
- 3-Cyanobenzyl alcohol
Deleted or Replaced CAS Registry Numbers
185532-93-8
