2-Butenamide, 2-cyano-3-(dimethylamino)-


Chemical Name: 2-Butenamide, 2-cyano-3-(dimethylamino)-
CAS Number: 62321-92-0
Product Number: AG003H3V(AGN-PC-0KKS05)
Synonyms:
MDL No: MFCD00663777
Molecular Formula: C7H11N3O
Molecular Weight: 153.1817

Identification/Properties


Properties
BP:
435.3°C at 760 mmHg
Computed Properties
Molecular Weight:
153.185g/mol
XLogP3:
-0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
153.09g/mol
Monoisotopic Mass:
153.09g/mol
Topological Polar Surface Area:
70.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
244
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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