Hexanenitrile, 6-bromo-


Chemical Name: Hexanenitrile, 6-bromo-
CAS Number: 6621-59-6
Product Number: AG003N4Q(AGN-PC-0JLT0U)
Synonyms:
MDL No:
Molecular Formula: C6H10BrN
Molecular Weight: 176.0543

Identification/Properties


Properties
BP:
134°C at 13 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.477(lit.)
Computed Properties
Molecular Weight:
176.057g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
4
Exact Mass:
175g/mol
Monoisotopic Mass:
175g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
81.8
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:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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