5-bromo-1-tert-butyl-6-propoxybenzimidazole


Chemical Name: 5-bromo-1-tert-butyl-6-propoxybenzimidazole
CAS Number: 1314985-53-9
Product Number: AG000WC6(AGN-PC-0AC0VN)
Synonyms:
MDL No:
Molecular Formula: C14H19BrN2O
Molecular Weight: 311.2175

Identification/Properties


Computed Properties
Molecular Weight:
311.223g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
310.068g/mol
Monoisotopic Mass:
310.068g/mol
Topological Polar Surface Area:
27A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
280
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

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NMR Spectrum


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