Octane, 2-bromo-


Chemical Name: Octane, 2-bromo-
CAS Number: 557-35-7
Product Number: AG00I9XP(AGN-PC-0JLRRB)
Synonyms:
MDL No:
Molecular Formula: C8H17Br
Molecular Weight: 193.1246

Identification/Properties


Computed Properties
Molecular Weight:
193.128g/mol
XLogP3:
4.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
5
Exact Mass:
192.051g/mol
Monoisotopic Mass:
192.051g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
52.5
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:
Warning
UN#:
-
Hazard Statements:
H227-H315-H319
Precautionary Statements:
P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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