Basic information
- Standard SMILES
C#CC(C)(O)c1nc(C)cs1- InChIKey
ULIKYCNITLBMGE-UHFFFAOYSA-N- Molecular formula
- C8H9NOS
- Average molar mass
- 167.23 g/mol
Names & identifiers
- Preferred name
- 2-(4-Methyl-1,3-thiazol-2-yl)but-3-yn-2-ol
- IUPAC
- 2-(4-methyl-1,3-thiazol-2-yl)but-3-yn-2-ol
Names & synonyms
2-(4-methyl-1,3-thiazol-2-yl)but-3-yn-2-olSCHEMBL1612472ULIKYCNITLBMGE-UHFFFAOYSA-NDB-1482981202772-36-8
Database identifiers
- PubChem CID
- 86669573
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 198
Related reactions
2 records
Compound notes
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