Basic information
- Standard SMILES
COC(=O)c1ccc(C=NO)s1- InChIKey
NJBSTPMFADDUBQ-UHFFFAOYSA-N- Molecular formula
- C7H7NO3S
- Average molar mass
- 185.2 g/mol
Names & identifiers
- Preferred name
- Methyl 5-((hydroxyimino)methyl)thiophene-2-carboxylate
- IUPAC
- methyl 5-(hydroxyiminomethyl)thiophene-2-carboxylate
Names & synonyms
SCHEMBL2224832NJBSTPMFADDUBQ-UHFFFAOYSA-Nmethyl 5-((hydroxyimino)methyl)thiophene-2-carboxylate
Database identifiers
- PubChem CID
- 72740488
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 195
Related reactions
2 records
Linked notes
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