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84761-81-9 | 1,2,8-TRIBROMODIBENZOFURAN
CAS No: 84761-81-9 Catalog No: AG004OWE MDL No:
Product Description
Catalog Number:
AG004OWE
Chemical Name:
1,2,8-TRIBROMODIBENZOFURAN
CAS Number:
84761-81-9
Molecular Formula:
C12H5Br3O
Molecular Weight:
404.8795
IUPAC Name:
1,2,8-tribromodibenzofuran
InChI:
InChI=1S/C12H5Br3O/c13-6-1-3-9-7(5-6)11-10(16-9)4-2-8(14)12(11)15/h1-5H
InChI Key:
LQKAHTKRUKHSDG-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c1c(o2)ccc(c1Br)Br
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.787g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
404.883g/mol
Monoisotopic Mass:
401.789g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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