Home Nitriles Propanenitrile,2-methyl-

Propanenitrile,2-methyl-

CAS No.:
78-82-0
Catalog Number:
AG0038FM
Molecular Formula:
C4H7N
Molecular Weight:
69.1051
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Product Description
Catalog Number:
AG0038FM
Chemical Name:
Propanenitrile,2-methyl-
CAS Number:
78-82-0
Molecular Formula:
C4H7N
Molecular Weight:
69.1051
MDL Number:
MFCD00001873
IUPAC Name:
2-methylpropanenitrile
InChI:
InChI=1S/C4H7N/c1-4(2)3-5/h4H,1-2H3
InChI Key:
LRDFRRGEGBBSRN-UHFFFAOYSA-N
SMILES:
CC(C#N)C
EC Number:
201-147-5
UNII:
699AWF2WV2
NSC Number:
60536
RTECS Number:
TZ4900000
UN Number:
2284
Properties
Complexity:
55.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
69.058g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
69.107g/mol
Monoisotopic Mass:
69.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
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Properties