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CAS Number: 175696-73-8
3-(pyrrolidin-1-yl)benzonitrile

Structure

3-(pyrrolidin-1-yl)benzonitrile
Name: 3-(pyrrolidin-1-yl)benzonitrile
Synonyms:
General Information
Product Number: 175696738

CAS Registry Number 175696-73-8
Name:
Benzonitrile, 3-?(1-?pyrrolidinyl)?-
3-(Pyrrolidin-1-yl)benzonitrile
3-Pyrrolidinobenzonitrile
N-(3-Cyanophenyl)pyrrolidine

 

Chemical Formula: C11H12N2
Exact Mass: 172.10
Molecular Weight: 172.23
m/z: 172.10 (100.0%), 173.10 (12.6%)

 

InChI:InChI=1S/C11H12N2/c12-9-10-4-3-5-11(8-10)13-6-1-2-7-13/h3-5,8H,1-2,6-7H2

InChI Key:UMJBSSQWHKPDJF-UHFFFAOYSA-N

Canonical SMILES:C1CCN(C1)C2=CC=CC(=C2)C#N

 

Thermal Properties Value Condition Note
Melting Point 85-86 °C   (1)CAS

Specification

98%

References
  1. (1) Wolfe, John P.; Journal of Organic Chemistry 2000, V65(4), P1158-1174 CAPLUS
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