tert-butyl 4-bromo-2-methylbenzoate


Chemical Name: tert-butyl 4-bromo-2-methylbenzoate
CAS Number: 445003-37-2
Product Number: AG00DKKF(AGN-PC-09T63I)
Synonyms:
MDL No:
Molecular Formula: C12H15BrO2
Molecular Weight: 271.1503

Identification/Properties


Computed Properties
Molecular Weight:
271.154g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
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:
232
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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