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7781-70-6 | Benzene, 1,1'-[1,2-bis(bromomethyl)-1,2-ethenediyl]bis-
CAS No: 7781-70-6 Catalog No: AG005F26 MDL No:
Product Description
Catalog Number:
AG005F26
Chemical Name:
Benzene, 1,1'-[1,2-bis(bromomethyl)-1,2-ethenediyl]bis-
CAS Number:
7781-70-6
Molecular Formula:
C16H14Br2
Molecular Weight:
366.0904
IUPAC Name:
(1,4-dibromo-3-phenylbut-2-en-2-yl)benzene
InChI:
InChI=1S/C16H14Br2/c17-11-15(13-7-3-1-4-8-13)16(12-18)14-9-5-2-6-10-14/h1-10H,11-12H2
InChI Key:
LHQCGRPIRYILLZ-UHFFFAOYSA-N
SMILES:
BrCC(=C(c1ccccc1)CBr)c1ccccc1
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.944g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.096g/mol
Monoisotopic Mass:
363.946g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.8
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