Benzene, bromobutoxy-


Chemical Name: Benzene, bromobutoxy-
CAS Number: 1200-03-9
Product Number: AG000Q16(AGN-PC-0JLA26)
Synonyms:
MDL No:
Molecular Formula: C10H13BrO
Molecular Weight: 229.1136

Identification/Properties


Computed Properties
Molecular Weight:
229.117g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
5
Exact Mass:
228.015g/mol
Monoisotopic Mass:
228.015g/mol
Topological Polar Surface Area:
9.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
100
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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