Benzene, [[(5-bromopentyl)oxy]methyl]-


Chemical Name: Benzene, [[(5-bromopentyl)oxy]methyl]-
CAS Number: 1014-93-3
Product Number: AG0004EV(AGN-PC-000R3J)
Synonyms:
MDL No:
Molecular Formula: C12H17BrO
Molecular Weight: 257.1668

Identification/Properties


Properties
BP:
303.757°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
1.5220-1.5260
Computed Properties
Molecular Weight:
257.171g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
7
Exact Mass:
256.046g/mol
Monoisotopic Mass:
256.046g/mol
Topological Polar Surface Area:
9.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
122
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
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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