Home Halogens 2-chloro-2-methylpropiononitrile

2-chloro-2-methylpropiononitrile

CAS No.:
3331-60-0
Catalog Number:
AG00CRTO
Molecular Formula:
C4H6ClN
Molecular Weight:
103.5501
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Product Description
Catalog Number:
AG00CRTO
Chemical Name:
2-chloro-2-methylpropiononitrile
CAS Number:
3331-60-0
Molecular Formula:
C4H6ClN
Molecular Weight:
103.5501
IUPAC Name:
2-chloro-2-methylpropanenitrile
InChI:
InChI=1S/C4H6ClN/c1-4(2,5)3-6/h1-2H3
InChI Key:
AMAFFZUDKROYAJ-UHFFFAOYSA-N
SMILES:
N#CC(Cl)(C)C
EC Number:
222-057-2
Properties
Complexity:
87  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
103.019g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
103.549g/mol
Monoisotopic Mass:
103.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties