4-(Chloromethyl)-2-(7-oxabicyclo[4.1.0]hept-3-yl)-1,3-dioxolane
Basic information
- CAS
97321-38-5- Standard SMILES
ClCC1COC(C2CCC3OC3C2)O1- InChIKey
NBDKOJSGJIGOBM-UHFFFAOYSA-N- Molecular formula
- C10H15ClO3
- Average molar mass
- 218.68 g/mol
- Monoisotopic mass
- 218.070972
Names & identifiers
- Preferred name
- 4-(Chloromethyl)-2-(7-oxabicyclo[4.1.0]hept-3-yl)-1,3-dioxolane
- IUPAC
- 3-[4-(chloromethyl)-1,3-dioxolan-2-yl]-7-oxabicyclo[4.1.0]heptane
Names & synonyms
ST5100184597321-38-53-[4-(chloromethyl)-1,3-dioxolan-2-yl]-7-oxabicyclo[4.1.0]heptaneDTXSID304034644-(chloromethyl)-2-(7-oxabicyclo[4.1.0]hept-3-yl)-1,3-dioxolaneAKOS024367818
Database identifiers
- CAS
97321-38-5- PubChem CID
- 4454956
- DTXSID
DTXSID30403464
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 31 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 223
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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