Basic information
- Standard SMILES
ClCc1coc(Cc2cccs2)n1- InChIKey
VVIJAGGNFXOZNX-UHFFFAOYSA-N- Molecular formula
- C9H8ClNOS
- Average molar mass
- 213.68 g/mol
- Monoisotopic mass
- 213.0015127
Names & identifiers
- Preferred name
- 4-Chloromethyl-2-(2-thienylmethyl)oxazole
- IUPAC
- 4-(chloromethyl)-2-(thiophen-2-ylmethyl)-1,3-oxazole
Names & synonyms
SCHEMBL5758310VVIJAGGNFXOZNX-UHFFFAOYSA-N4-chloromethyl-2-(2-thienylmethyl)oxazole
Database identifiers
- PubChem CID
- 22009608
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Related reactions
1 records
Compound notes
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