Benzoic acid, 4-(bromomethyl)-, 1,1-dimethylethyl ester


Chemical Name: Benzoic acid, 4-(bromomethyl)-, 1,1-dimethylethyl ester
CAS Number: 108052-76-2
Product Number: AG003K6L(AGN-PC-008N12)
Synonyms:
MDL No:
Molecular Formula: C12H15BrO2
Molecular Weight: 271.1503

Identification/Properties


Properties
BP:
320.9°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
271.154g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
270.026g/mol
Monoisotopic Mass:
270.026g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
15
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


NMR Spectrum


Other Analytical Data


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