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Benzo[b]thiophene-2-carbonyl chloride

Catalog Number
ACM39827117
CAS Number
39827-11-7
Product Name
Benzo[b]thiophene-2-carbonyl chloride
Structure
Category
Small Molecule Semiconductor Building Blocks
Synonyms
Thianaphthene-2-carbonyl chloride;1-Benzothiophene-2-carbonyl chloride
IUPAC Name
1-benzothiophene-2-carbonyl chloride
Molecular Weight
196.65g/mol
Molecular Formula
C9H5ClOS
Canonical SMILES
C1=CC=C2C(=C1)C=C(S2)C(=O)Cl
InChI
InChI=1S/C9H5ClOS/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h1-5H
InChI Key
DNGLRCHMGDDHNC-UHFFFAOYSA-N
Boiling Point
176°C/17mmHg(lit.)
Melting Point
85-86°C
Purity
98%
Appearance
White Crystal
Complexity
195
Covalently-Bonded Unit Count
1
Exact Mass
195.974964g/mol
Formal Charge
0
Heavy Atom Count
12
Monoisotopic Mass
195.974964g/mol
Rotatable Bond Count
1
XLogP3
3.8
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