Basic information
- CAS
52129-03-0- Standard SMILES
CC1(C)OCC(c2ccccc2)O1- InChIKey
SFDXYHMRHIVYET-UHFFFAOYSA-N- Molecular formula
- C11H14O2
- Average molar mass
- 178.23 g/mol
- Monoisotopic mass
- 178.09937969
Names & identifiers
- Preferred name
- 2,2-Dimethyl-4-phenyl-1,3-dioxolane
- IUPAC
- 2,2-dimethyl-4-phenyl-1,3-dioxolane
- English name
- 2,2-Dimethyl-4-phenyl-1,3-dioxolane
- Molecular formula
- C11H14O2
- Molecular weight
- 178.23
Names & synonyms
2,2-Dimethyl-4-phenyl-1,3-dioxolane52129-03-0SCHEMBL6372800SCHEMBL7787343DTXSID701356384Acetone-1-phenyl 1,2-ethandiol ketalAKOS0243381062,2-Dimethyl-4-phenyl-1,3-dioxolane #2,2-DIMETHYL-4-PHENYL-1,3-DIOXOLAN1,3-Dioxolane, 2,2-dimethyl-4-phenyl-
Database identifiers
- CAS
52129-03-0- PubChem CID
- 537869
- DTXSID
DTXSID701356384- Nikkaji
- J182.468F
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 171
Physicochemical properties
- Boiling point
- 246 °C · 246 °C
- Density
- 1.027 · 1.027±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
ASDI-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…