Butanenitrile, 4-chloro-


Chemical Name: Butanenitrile, 4-chloro-
CAS Number: 628-20-6
Product Number: AG003L73(AGN-PC-0JKAJD)
Synonyms:
MDL No:
Molecular Formula: C4H6ClN
Molecular Weight: 103.5501

Identification/Properties


Properties
MP:
-44°C
BP:
195-197°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.442(lit.)
Computed Properties
Molecular Weight:
103.549g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
103.019g/mol
Monoisotopic Mass:
103.019g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
61.2
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3276
Hazard Statements:
H227-H301
Precautionary Statements:
P301+P310
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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