2-Propenenitrile, 3-(4-chlorophenyl)-


Chemical Name: 2-Propenenitrile, 3-(4-chlorophenyl)-
CAS Number: 28446-72-2
Product Number: AG003L78(AGN-PC-0JKNN8)
Synonyms:
MDL No:
Molecular Formula: C9H6ClN
Molecular Weight: 163.60364

Identification/Properties


Properties
MP:
55-70 °C(lit.)
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
163.604g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
163.019g/mol
Monoisotopic Mass:
163.019g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
181
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


NMR Spectrum


Other Analytical Data


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