Basic information
- Standard SMILES
COCC1OC1(Cl)C(=O)OC(C)(C)C- InChIKey
BLMOSVPBCUOIDL-UHFFFAOYSA-N- Molecular formula
- C9H15ClO4
- Average molar mass
- 222.66 g/mol
Names & identifiers
- Preferred name
- 1,1-Dimethylethyl 2-chloro-3-methoxymethyloxirane-carboxylate
- IUPAC
- tert-butyl 2-chloro-3-(methoxymethyl)oxirane-2-carboxylate
Names & synonyms
SCHEMBL8841129BLMOSVPBCUOIDL-UHFFFAOYSA-N1,1-dimethylethyl 2-chloro-3-methoxymethyloxirane-carboxylate
Database identifiers
- PubChem CID
- 21478445
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 235
Related reactions
3 records
Compound notes
Loading…