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5-Bromobenzo[b]thiophene

Catalog Number
ACM4923879
Product Name
5-Bromobenzo[b]thiophene
Structure
CAS
4923-87-9
Category
Small Molecule Semiconductor Building Blocks
Synonyms
5-Bromothianaphthene; 5-bromo-1-benzothiophene
IUPAC Name
5-bromo-1-benzothiophene
Molecular Weight
213.1g/mol
Molecular Formula
C8H5BrS
Canonical SMILES
C1=CC2=C(C=CS2)C=C1Br
InChI
InChI=1S/C8H5BrS/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H
InChI Key
RDSIMGKJEYNNLF-UHFFFAOYSA-N
Boiling Point
284.7 °C/760mmHg
Melting Point
46 °C(lit.)
Flash Point
126°C
Density
1.649 g/cm³ at 25 °C(lit.)
Complexity
126
Covalently-Bonded Unit Count
1
Exact Mass
211.92953g/mol
Formal Charge
0
Heavy Atom Count
10
Monoisotopic Mass
211.92953g/mol
Rotatable Bond Count
0
XLogP3
3.8
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