2-Propenenitrile, 3-(dimethylamino)-, (2E)-


Chemical Name: 2-Propenenitrile, 3-(dimethylamino)-, (2E)-
CAS Number: 35520-41-3
Product Number: AG003UX1(AGN-PC-0O998Z)
Synonyms:
MDL No:
Molecular Formula: C5H8N2
Molecular Weight: 96.13042

Identification/Properties


Properties
BP:
76-80 °C0.3 mm Hg(lit.)
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.533(lit.)
Computed Properties
Molecular Weight:
96.133g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
96.069g/mol
Monoisotopic Mass:
96.069g/mol
Topological Polar Surface Area:
27A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
105
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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