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1196475-57-6 | Benzeneethanol, 2-bromo-β-phenyl-
CAS No: 1196475-57-6 Catalog No: AG000PEI MDL No:
Product Description
Catalog Number:
AG000PEI
Chemical Name:
Benzeneethanol, 2-bromo-β-phenyl-
CAS Number:
1196475-57-6
Molecular Formula:
C14H13BrO
Molecular Weight:
277.1564
IUPAC Name:
2-(2-bromophenyl)-2-phenylethanol
InChI:
InChI=1S/C14H13BrO/c15-14-9-5-4-8-12(14)13(10-16)11-6-2-1-3-7-11/h1-9,13,16H,10H2
InChI Key:
ZUZGTFFTHQPHIC-UHFFFAOYSA-N
SMILES:
OCC(c1ccccc1Br)c1ccccc1
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.015g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.161g/mol
Monoisotopic Mass:
276.015g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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