α,α,γ-Trimethylbenzenebutanenitrile
CAS Registry Number®
75490-39-0
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CAS Name
α,α,γ-TrimethylbenzenebutanenitrileMolecular Formula
C13H17NMolecular Mass
187.28Cite this Page
α,α,γ-Trimethylbenzenebutanenitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=75490-39-0 (retrieved ) (CAS RN: 75490-39-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
100 °C @ Press: 1.5 TorrDensity (1)
0.9425 g/cm³ @ Temp: 20 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C13H17N/c1-11(9-13(2,3)10-14)12-7-5-4-6-8-12/h4-8,11H,9H2,1-3H3
InChIKey
InChIKey=GWCCFAFCQHECBM-UHFFFAOYSA-N
SMILES
C(CC(C#N)(C)C)(C)C1=CC=CC=C1
Canonical SMILES
N#CC(C)(C)CC(C=1C=CC=CC1)C
Other Names for this Substance
- Benzenebutanenitrile, α,α,γ-trimethyl-
- Valeronitrile, 2,2-dimethyl-4-phenyl-
- α,α,γ-Trimethylbenzenebutanenitrile
- 2,2,4-Trimethyl-4-phenylbutanenitrile
- 2,2-Dimethyl-4-phenyl-valeronitrile
