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5-Chlorothiophene-2-carboxylic acid

Catalog Number
ACM24065336
CAS Number
24065-33-6
Product Name
5-Chlorothiophene-2-carboxylic acid
Structure
Category
Electroluminescence Materials
Synonyms
2-Thiophenecarboxylic acid, 5-chloro-;5-chlorothiophenecarboxylic acid
IUPAC Name
5-chlorothiophene-2-carboxylic acid
Molecular Weight
162.59g/mol
Molecular Formula
C5H3ClO2S
Canonical SMILES
C1=C(SC(=C1)Cl)C(=O)O
InChI
InChI=1S/C5H3ClO2S/c6-4-2-1-3(9-4)5(7)8/h1-2H,(H,7,8)
InChI Key
QZLSBOVWPHXCLT-UHFFFAOYSA-N
Melting Point
154-158°C
Purity
98%
Appearance
Gray Solid
Complexity
128
Covalently-Bonded Unit Count
1
EC Number
480-060-6;607-311-6
Exact Mass
161.954228g/mol
Formal Charge
0
Heavy Atom Count
9
Monoisotopic Mass
161.954228g/mol
NSC Number
14776
Rotatable Bond Count
1
XLogP3
2.4
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