Basic information
- Standard SMILES
O=C([O-])c1cccs1- InChIKey
QERYCTSHXKAMIS-UHFFFAOYSA-M- Molecular formula
- C5H3O2S-
- Average molar mass
- 127.14 g/mol
Overview
Thiophene-2-carboxylate is a monocarboxylic acid anion that is the conjugate base of thiophene-2-carboxylic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. It is a conjugate base of a thiophene-2-carboxylic acid.
Names & identifiers
- Preferred name
- Thiophene-2-carboxylate
- IUPAC
- thiophene-2-carboxylate
Names & synonyms
Thiophene-2-carboxylate2-thiophenecarboxylate2-thienoate2-carboxylatothiopheneCHEBI:71237RefChem:18961620897-85-22-thiophencarboxylic acidthenatthen-atthienyl-2-carboxylateThiofuran-2-carboxylic acid
Show more names
QERYCTSHXKAMIS-UHFFFAOYSA-MQ27139461
Database identifiers
- PubChem CID
- 5017639
- ChEBI
CHEBI:71237- Nikkaji
- J386.308E
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- -1
- Complexity
- 97.1
Related reactions
34 records
Compound notes
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