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Home > Bromides > 1236538-59-2
1236538-59-2 | Benzo[b]thiophene, 7-bromo-5-chloro-
CAS No: 1236538-59-2 Catalog No: AG000KXF MDL No:MFCD22560534
Product Description
Catalog Number:
AG000KXF
Chemical Name:
Benzo[b]thiophene, 7-bromo-5-chloro-
CAS Number:
1236538-59-2
Molecular Formula:
C8H4BrClS
Molecular Weight:
247.5394
MDL Number:
MFCD22560534
IUPAC Name:
7-bromo-5-chloro-1-benzothiophene
InChI:
InChI=1S/C8H4BrClS/c9-7-4-6(10)3-5-1-2-11-8(5)7/h1-4H
InChI Key:
INZLVUHXYROTAK-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c2c(c1)ccs2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.891g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.534g/mol
Monoisotopic Mass:
245.891g/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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