Propanenitrile, chloro-


Chemical Name: Propanenitrile, chloro-
CAS Number: 1617-17-0
Product Number: AG001VTN(AGN-PC-0JLSK5)
Synonyms:
MDL No:
Molecular Formula: C3H4ClN
Molecular Weight: 89.5236

Identification/Properties


Properties
BP:
122.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Refractive Index:
n20/D 1.413(lit.)
Computed Properties
Molecular Weight:
89.522g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
89.003g/mol
Monoisotopic Mass:
89.003g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
5
Formal Charge:
0
Complexity:
60.5
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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#:
3275
Hazard Statements:
H226-H301+H311+H331-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P310-P305+P351+P338-P311
Class:
6.1,3
Packing Group:

NMR Spectrum


Other Analytical Data


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