Phenol, 4-bromo-2,6-bis(1,1-dimethylethyl)-


Chemical Name: Phenol, 4-bromo-2,6-bis(1,1-dimethylethyl)-
CAS Number: 1139-52-2
Product Number: AG000A19(AGN-PC-0JL9YG)
Synonyms:
MDL No:
Molecular Formula: C14H21BrO
Molecular Weight: 285.2199

Identification/Properties


Properties
MP:
78-83 °C
BP:
273.898 °C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5130 (estimate)
Computed Properties
Molecular Weight:
285.225g/mol
XLogP3:
5.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
284.078g/mol
Monoisotopic Mass:
284.078g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
212
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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