Basic information
- Standard SMILES
ClCCCC1(c2ccccc2)OCCO1- InChIKey
MNGUYQVJFSKJOJ-UHFFFAOYSA-N- Molecular formula
- C12H15ClO2
- Average molar mass
- 226.7 g/mol
- Monoisotopic mass
- 226.0760574
Names & identifiers
- Preferred name
- 2-(3-Chloropropyl)-2-phenyl-1,3-dioxolane
- IUPAC
- 2-(3-chloropropyl)-2-phenyl-1,3-dioxolane
Names & synonyms
2-(3-chloropropyl)-2-phenyl-1,3-dioxolane3308-98-3SCHEMBL1594432MNGUYQVJFSKJOJ-UHFFFAOYSA-N2-phenyl-2-(3'-chloropropyl)dioxolaneDA-284462-phenyl-2-(3-chloropropyl)-1,3-dioxolane2-(3-chloropropyl)-2-phenyl-[1,3]dioxolane
Database identifiers
- PubChem CID
- 12866338
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 184
Related reactions
10 records
Compound notes
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