Basic information
- Standard SMILES
CCc1coc(=S)[nH]1- InChIKey
PHHRHBPXOABHIZ-UHFFFAOYSA-N- Molecular formula
- C5H7NOS
- Average molar mass
- 129.18 g/mol
- Monoisotopic mass
- 129.02483502
Names & identifiers
- Preferred name
- 4-Ethyl-2-thiono-4-oxazoline
- IUPAC
- 4-ethyl-3H-1,3-oxazole-2-thione
Names & synonyms
4-ethyl-2-thiono-4-oxazolineSCHEMBL6803477SCHEMBL11446276PHHRHBPXOABHIZ-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 22714645
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 141
Related reactions
4 records
Compound notes
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