2-Bromo-5-methylhexane


Chemical Name: 2-Bromo-5-methylhexane
CAS Number: 6570-93-0
Product Number: AG003GQ5(AGN-PC-0WAM5V)
Synonyms:
MDL No:
Molecular Formula: C7H15Br
Molecular Weight: 179.0980

Identification/Properties


Computed Properties
Molecular Weight:
179.101g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
3
Exact Mass:
178.036g/mol
Monoisotopic Mass:
178.036g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
50.3
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#:
1992
Hazard Statements:
H226-H301-H311-H331-H341
Precautionary Statements:
P201-P202-P210-P243-P261-P264-P270-P271-P280-P302+P352-P303+P361+P353-P304+P340-P308+P313-P310-P330-P361-P370+P378-P403+P233-P403+P235-P405-P501
Class:
3,6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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