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80274-92-6 | 1,2,4-TRIBROMO-5-(2,6-DIBROMOPHENYL)BENZENE
CAS No: 80274-92-6 Catalog No: AG005BTO MDL No:
Product Description
Catalog Number:
AG005BTO
Chemical Name:
1,2,4-TRIBROMO-5-(2,6-DIBROMOPHENYL)BENZENE
CAS Number:
80274-92-6
Molecular Formula:
C12H5Br5
Molecular Weight:
548.6881
IUPAC Name:
1,2,4-tribromo-5-(2,6-dibromophenyl)benzene
InChI:
InChI=1S/C12H5Br5/c13-7-2-1-3-8(14)12(7)6-4-10(16)11(17)5-9(6)15/h1-5H
InChI Key:
KXIAEPPRBPRPKO-UHFFFAOYSA-N
SMILES:
Brc1cc(Br)c(cc1c1c(Br)cccc1Br)Br
UNII:
N4MQQ1359B
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
547.627g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
548.692g/mol
Monoisotopic Mass:
543.631g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
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