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247089-76-5 | Benzenemethanol, 3-bromo-α-(4-fluorophenyl)-
CAS No: 247089-76-5 Catalog No: AG002P4M MDL No:MFCD12153608
Product Description
Catalog Number:
AG002P4M
Chemical Name:
Benzenemethanol, 3-bromo-α-(4-fluorophenyl)-
CAS Number:
247089-76-5
Molecular Formula:
C13H10BrFO
Molecular Weight:
281.1203
MDL Number:
MFCD12153608
IUPAC Name:
(3-bromophenyl)-(4-fluorophenyl)methanol
InChI:
InChI=1S/C13H10BrFO/c14-11-3-1-2-10(8-11)13(16)9-4-6-12(15)7-5-9/h1-8,13,16H
InChI Key:
YBUFCLFBGOTIMD-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(c1cccc(c1)Br)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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