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3-Chlorothiophene

Catalog Number
ACM17249808
Product Name
3-Chlorothiophene
Structure
CAS
17249-80-8
Category
Electroluminescence Materials
Synonyms
Thiophene, 3-chloro-
IUPAC Name
3-chlorothiophene
Molecular Weight
118.59g/mol
Molecular Formula
C4H3ClS
Canonical SMILES
C1=CSC=C1Cl
InChI
InChI=1S/C4H3ClS/c5-4-1-2-6-3-4/h1-3H
InChI Key
QUBJDMPBDURTJT-UHFFFAOYSA-N
Boiling Point
137-139 °C
Flash Point
37 °C
Purity
98%
Density
1.276 g/mL at 25 °C(lit.)
Appearance
Colorless Clear Liquid
Complexity
46.8
Covalently-Bonded Unit Count
1
Exact Mass
117.964399g/mol
Formal Charge
0
Heavy Atom Count
6
Log P
2.55 (LogP)
Monoisotopic Mass
117.964399g/mol
Rotatable Bond Count
0
XLogP3
2.6
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