Home Nitriles 3-Amino-5-methylbenzonitrile

3-Amino-5-methylbenzonitrile

CAS No.:
186551-97-3
Catalog Number:
AG00AS8N
Molecular Formula:
C8H8N2
Molecular Weight:
132.1625
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$292
- +
1g
95%
1 week
United States
$674
- +
Product Description
Catalog Number:
AG00AS8N
Chemical Name:
3-Amino-5-methylbenzonitrile
CAS Number:
186551-97-3
Molecular Formula:
C8H8N2
Molecular Weight:
132.1625
MDL Number:
MFCD13176491
IUPAC Name:
3-amino-5-methylbenzonitrile
InChI:
InChI=1S/C8H8N2/c1-6-2-7(5-9)4-8(10)3-6/h2-4H,10H2,1H3
InChI Key:
UNPIGVYJSNRGBR-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C)cc(c1)N
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