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Home > Bromides > 1282206-43-2
1282206-43-2 | 3-Bromo-4'-fluoro-2'-methylbenzhydrol
CAS No: 1282206-43-2 Catalog No: AG01FD0A MDL No:
Product Description
Catalog Number:
AG01FD0A
Chemical Name:
3-Bromo-4'-fluoro-2'-methylbenzhydrol
CAS Number:
1282206-43-2
Molecular Formula:
C14H12BrFO
Molecular Weight:
295.1469
IUPAC Name:
(3-bromophenyl)-(4-fluoro-2-methylphenyl)methanol
InChI:
InChI=1S/C14H12BrFO/c1-9-7-12(16)5-6-13(9)14(17)10-3-2-4-11(15)8-10/h2-8,14,17H,1H3
InChI Key:
NRJLVYKCCHZOCV-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)C)C(c1cccc(c1)Br)O
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.006g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.151g/mol
Monoisotopic Mass:
294.006g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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