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1423-62-7 | Benzo[b]thiophene, 3,5-dibromo-
CAS No: 1423-62-7 Catalog No: AG001I5D MDL No:
Product Description
Catalog Number:
AG001I5D
Chemical Name:
Benzo[b]thiophene, 3,5-dibromo-
CAS Number:
1423-62-7
Molecular Formula:
C8H4Br2S
Molecular Weight:
291.9904
IUPAC Name:
3,5-dibromo-1-benzothiophene
InChI:
InChI=1S/C8H4Br2S/c9-5-1-2-8-6(3-5)7(10)4-11-8/h1-4H
InChI Key:
PYYZYZQDDICZEQ-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(Br)cs2
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.838g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.988g/mol
Monoisotopic Mass:
289.84g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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