Home Nitriles 2-(Benzylamino)benzonitrile

2-(Benzylamino)benzonitrile

CAS No.:
5589-62-8
Catalog Number:
AG00DKKY
Molecular Formula:
C14H12N2
Molecular Weight:
208.2585
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$200
- +
5g
98%
In Stock USA
United States
$600
- +
10g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG00DKKY
Chemical Name:
2-(Benzylamino)benzonitrile
CAS Number:
5589-62-8
Molecular Formula:
C14H12N2
Molecular Weight:
208.2585
MDL Number:
MFCD00512083
IUPAC Name:
2-(benzylamino)benzonitrile
InChI:
InChI=1S/C14H12N2/c15-10-13-8-4-5-9-14(13)16-11-12-6-2-1-3-7-12/h1-9,16H,11H2
InChI Key:
JNNJQGFCEMZAQR-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1NCc1ccccc1
NSC Number:
291289
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.1g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.264g/mol
Monoisotopic Mass:
208.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties