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115665-68-4 | Benzene, 1-bromo-4-[(1Z)-2-bromoethenyl]-
CAS No: 115665-68-4 Catalog No: AG000GPN MDL No:MFCD22192474
Product Description
Catalog Number:
AG000GPN
Chemical Name:
Benzene, 1-bromo-4-[(1Z)-2-bromoethenyl]-
CAS Number:
115665-68-4
Molecular Formula:
C8H6Br2
Molecular Weight:
261.9412
MDL Number:
MFCD22192474
IUPAC Name:
1-bromo-4-(2-bromoethenyl)benzene
InChI:
InChI=1S/C8H6Br2/c9-6-5-7-1-3-8(10)4-2-7/h1-6H
InChI Key:
AASXNYRCBGBZJK-UHFFFAOYSA-N
SMILES:
Br/C=C\c1ccc(cc1)Br
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.882g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.944g/mol
Monoisotopic Mass:
259.884g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.7
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