Home Nitriles 3-(3-Aminophenyl)benzonitrile, HCl

3-(3-Aminophenyl)benzonitrile, HCl

CAS No.:
1049744-24-2
Catalog Number:
AG00949M
Molecular Formula:
C13H11ClN2
Molecular Weight:
230.6928
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00949M
Chemical Name:
3-(3-Aminophenyl)benzonitrile, HCl
CAS Number:
1049744-24-2
Molecular Formula:
C13H11ClN2
Molecular Weight:
230.6928
MDL Number:
MFCD06656006
IUPAC Name:
3-(3-aminophenyl)benzonitrile;hydrochloride
InChI:
InChI=1S/C13H10N2.ClH/c14-9-10-3-1-4-11(7-10)12-5-2-6-13(15)8-12;/h1-8H,15H2;1H
InChI Key:
NYOUTQMBXQFWJN-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)c1cccc(c1)N.Cl
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.061g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.695g/mol
Monoisotopic Mass:
230.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties