Home Nitriles 2-(1H-Pyrrol-1-yl)benzonitrile

2-(1H-Pyrrol-1-yl)benzonitrile

CAS No.:
33265-71-3
Catalog Number:
AG00BZIT
Molecular Formula:
C11H8N2
Molecular Weight:
168.1946
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$50
- +
5g
96%
In Stock USA
United States
$169
- +
25g
96%
In Stock USA
United States
$485
- +
Product Description
Catalog Number:
AG00BZIT
Chemical Name:
2-(1H-Pyrrol-1-yl)benzonitrile
CAS Number:
33265-71-3
Molecular Formula:
C11H8N2
Molecular Weight:
168.1946
MDL Number:
MFCD00128308
IUPAC Name:
2-pyrrol-1-ylbenzonitrile
InChI:
InChI=1S/C11H8N2/c12-9-10-5-1-2-6-11(10)13-7-3-4-8-13/h1-8H
InChI Key:
ZCTJXWVTLAHGAJ-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1n1cccc1
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.199g/mol
Monoisotopic Mass:
168.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties