Propanenitrile, 2,2-dimethyl-


Chemical Name: Propanenitrile, 2,2-dimethyl-
CAS Number: 630-18-2
Product Number: AG00360O(AGN-PC-0JKAKW)
Synonyms:
MDL No:
Molecular Formula: C5H9N
Molecular Weight: 83.1317

Identification/Properties


Properties
MP:
15-16 °C(lit.)
BP:
105.5°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.377(lit.)
Computed Properties
Molecular Weight:
83.134g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
83.073g/mol
Monoisotopic Mass:
83.073g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
77.8
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#:
1993
Hazard Statements:
H225-H301-H311-H331-H350-H370-H412
Precautionary Statements:
P201-P210-P260-P273-P280-P301+P310
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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