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149950-39-0 | 3-Bromo-3'-hydroxybiphenyl
CAS No: 149950-39-0 Catalog No: AG01FFGT MDL No:
Product Description
Catalog Number:
AG01FFGT
Chemical Name:
3-Bromo-3'-hydroxybiphenyl
CAS Number:
149950-39-0
Molecular Formula:
C12H9BrO
Molecular Weight:
249.1033
IUPAC Name:
3-(3-bromophenyl)phenol
InChI:
InChI=1S/C12H9BrO/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8,14H
InChI Key:
OVZWOSBQUGTLSU-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)c1cccc(c1)Br
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.984g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.107g/mol
Monoisotopic Mass:
247.984g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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