Home Nitriles 3-(Dimethylamino)acrylonitrile

3-(Dimethylamino)acrylonitrile

CAS No.:
2407-68-3
Catalog Number:
AG003I7T
Molecular Formula:
C5H8N2
Molecular Weight:
96.1304
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Product Description
Catalog Number:
AG003I7T
Chemical Name:
3-(Dimethylamino)acrylonitrile
CAS Number:
2407-68-3
Molecular Formula:
C5H8N2
Molecular Weight:
96.1304
MDL Number:
MFCD00001929
IUPAC Name:
(E)-3-(dimethylamino)prop-2-enenitrile
InChI:
InChI=1S/C5H8N2/c1-7(2)5-3-4-6/h3,5H,1-2H3/b5-3+
InChI Key:
ZKKBIZXAEDFPNL-HWKANZROSA-N
SMILES:
N#C/C=C/N(C)C
EC Number:
219-305-7
NSC Number:
127942
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
96.069g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
96.133g/mol
Monoisotopic Mass:
96.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties