methyl 3-bromo-5-propoxybenzoate


Chemical Name: methyl 3-bromo-5-propoxybenzoate
CAS Number: 1261956-31-3
Product Number: AG000S8O(AGN-PC-09PZH5)
Synonyms:
MDL No:
Molecular Formula: C11H13BrO3
Molecular Weight: 273.1231

Identification/Properties


Computed Properties
Molecular Weight:
273.126g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
272.005g/mol
Monoisotopic Mass:
272.005g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
208
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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