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16766-97-5 | Benzene, 1,1'-(1-bromo-1,2-ethanediyl)bis-
CAS No: 16766-97-5 Catalog No: AG001XJ5 MDL No:MFCD02066377
Product Description
Catalog Number:
AG001XJ5
Chemical Name:
Benzene, 1,1'-(1-bromo-1,2-ethanediyl)bis-
CAS Number:
16766-97-5
Molecular Formula:
C14H13Br
Molecular Weight:
261.1570
MDL Number:
MFCD02066377
IUPAC Name:
(1-bromo-2-phenylethyl)benzene
InChI:
InChI=1S/C14H13Br/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11H2
InChI Key:
TWPKIBFRKXFXRJ-UHFFFAOYSA-N
SMILES:
BrC(c1ccccc1)Cc1ccccc1
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.02g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.162g/mol
Monoisotopic Mass:
260.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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