Basic information
- Standard SMILES
O=C(O)C(=NO)c1cccs1- InChIKey
MRUYQGKJYNYKFC-UHFFFAOYSA-N- Molecular formula
- C6H5NO3S
- Average molar mass
- 171.18 g/mol
- Monoisotopic mass
- 170.9990142
Names & identifiers
- Preferred name
- 2-Hydroxyimino(thien-2-yl)acetic acid
- IUPAC
- 2-hydroxyimino-2-thiophen-2-ylacetic acid
Names & synonyms
SCHEMBL7512791MRUYQGKJYNYKFC-UHFFFAOYSA-N2-Hydroxyimino(thien-2-yl)acetic acid2-hydroxyimino-2-(thien-2-yl)acetic acid
Database identifiers
- PubChem CID
- 73629644
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 98.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 192
Related reactions
10 records
Compound notes
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