Home Nitriles Benzonitrile,3-amino-2-methyl-

Benzonitrile,3-amino-2-methyl-

CAS No.:
69022-35-1
Catalog Number:
AG005M5W
Molecular Formula:
C8H8N2
Molecular Weight:
132.1625
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Product Description
Catalog Number:
AG005M5W
Chemical Name:
Benzonitrile,3-amino-2-methyl-
CAS Number:
69022-35-1
Molecular Formula:
C8H8N2
Molecular Weight:
132.1625
MDL Number:
MFCD18389821
IUPAC Name:
3-amino-2-methylbenzonitrile
InChI:
InChI=1S/C8H8N2/c1-6-7(5-9)3-2-4-8(6)10/h2-4H,10H2,1H3
InChI Key:
BSMSSOYMWIEQKH-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1C)N
NSC Number:
79490
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.069g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
132.166g/mol
Monoisotopic Mass:
132.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties