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59142-67-5 | 2-Bromo-4'-fluorobenzhydrol
CAS No: 59142-67-5 Catalog No: AG01EWKB MDL No:
Product Description
Catalog Number:
AG01EWKB
Chemical Name:
2-Bromo-4'-fluorobenzhydrol
CAS Number:
59142-67-5
Molecular Formula:
C13H10BrFO
Molecular Weight:
281.1203
IUPAC Name:
(2-bromophenyl)-(4-fluorophenyl)methanol
InChI:
InChI=1S/C13H10BrFO/c14-12-4-2-1-3-11(12)13(16)9-5-7-10(15)8-6-9/h1-8,13,16H
InChI Key:
BSDDNYJEIVCQEZ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(c1ccccc1Br)O
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.99g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.124g/mol
Monoisotopic Mass:
279.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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