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129880-08-6 | Dibenzofuran, 1,2,3,4,7,8-hexabromo-
CAS No: 129880-08-6 Catalog No: AG000TQU MDL No:
Product Description
Catalog Number:
AG000TQU
Chemical Name:
Dibenzofuran, 1,2,3,4,7,8-hexabromo-
CAS Number:
129880-08-6
Molecular Formula:
C12H2Br6O
Molecular Weight:
641.5677
IUPAC Name:
1,2,3,4,7,8-hexabromodibenzofuran
InChI:
InChI=1S/C12H2Br6O/c13-4-1-3-6(2-5(4)14)19-12-7(3)8(15)9(16)10(17)11(12)18/h1-2H
InChI Key:
MAHGKVWEQHQGJI-UHFFFAOYSA-N
SMILES:
Brc1cc2c(cc1Br)oc1c2c(Br)c(c(c1Br)Br)Br
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
641.514g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
641.571g/mol
Monoisotopic Mass:
635.521g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.8
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