1-Propanol, 3-bromo-2,2-dimethyl-


Chemical Name: 1-Propanol, 3-bromo-2,2-dimethyl-
CAS Number: 40894-00-6
Product Number: AG0033LR(AGN-PC-0JMSO0)
Synonyms:
MDL No:
Molecular Formula: C5H11BrO
Molecular Weight: 167.0442

Identification/Properties


Properties
BP:
184-187 °C(lit.)
Storage:
Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.479(lit.)
Computed Properties
Molecular Weight:
167.046g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
165.999g/mol
Monoisotopic Mass:
165.999g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
52
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


NMR Spectrum


Other Analytical Data


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