Basic information
- CAS
4379-22-0- Standard SMILES
CCCC1(c2ccccc2)OCC(CO)O1- InChIKey
WTRULDHVZHPDHC-UHFFFAOYSA-N- Molecular formula
- C13H18O3
- Average molar mass
- 222.28 g/mol
- Monoisotopic mass
- 222.12559443
Names & identifiers
- Preferred name
- (2-Phenyl-2-propyl-1,3-dioxolan-4-yl)methanol
- IUPAC
- (2-phenyl-2-propyl-1,3-dioxolan-4-yl)methanol
Names & synonyms
4379-22-0(2-phenyl-2-propyl-1,3-dioxolan-4-yl)methanolDTXSID30963114RefChem:1049732DTXCID3013908832-Phenyl-2-propyl-1,3-dioxolane-4-methanolNSC 71401NSC714011,3-DIOXOLANE-4-METHANOL, 2-PHENYL-2-PROPYL-NSC-71401
Database identifiers
- CAS
4379-22-0- PubChem CID
- 20397
- DTXSID
DTXSID30963114
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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