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3-Thiophenecarboxaldehyde

Catalog Number
ACM498624
CAS Number
498-62-4
Product Name
3-Thiophenecarboxaldehyde
Structure
Category
Electroluminescence Materials; Polymers
Synonyms
Thiophene-3-carbaldehyde
IUPAC Name
thiophene-3-carbaldehyde
Molecular Weight
112.15g/mol
Molecular Formula
C5H4OS
Canonical SMILES
C1=CSC=C1C=O
InChI
InChI=1S/C5H4OS/c6-3-5-1-2-7-4-5/h1-4H
InChI Key
RBIGKSZIQCTIJF-UHFFFAOYSA-N
Boiling Point
194-196 °C
Melting Point
-30 °C
Flash Point
75 °C
Purity
98%
Density
1.28 g/mL at 25 °C(lit.)
Appearance
Light Yellow Liquid
Complexity
72.5
Covalently-Bonded Unit Count
1
EC Number
207-865-5
Exact Mass
111.998286g/mol
Formal Charge
0
Heavy Atom Count
7
Log P
1.01 (LogP)
Monoisotopic Mass
111.998286g/mol
NSC Number
172858
Rotatable Bond Count
1
XLogP3
1
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