Basic information
- Standard SMILES
CC1C(Cl)(Cl)CCC2OC21Cl- InChIKey
RTIZKDNAOLDNPG-UHFFFAOYSA-N- Molecular formula
- C7H9Cl3O
- Average molar mass
- 215.5 g/mol
Names & identifiers
- Preferred name
- 1,3,3-Trichloro-2-methyl-7-oxabicyclo[4.1.0]heptane
- IUPAC
- 1,3,3-trichloro-2-methyl-7-oxabicyclo[4.1.0]heptane
Names & synonyms
SCHEMBL9244216RTIZKDNAOLDNPG-UHFFFAOYSA-N1,3,3-trichloro-2-methyl-7-oxabicyclo[4.1.0]heptane
Database identifiers
- PubChem CID
- 18970971
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 194
Related reactions
4 records
Compound notes
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