Basic information
- CAS
58345-29-2- Standard SMILES
CCOC(=O)CC1(C)OCC(c2ccccc2)O1- InChIKey
YZRKSTVZZVKFSZ-UHFFFAOYSA-N- Molecular formula
- C14H18O4
- Average molar mass
- 250.29 g/mol
- Monoisotopic mass
- 250.12050905
Names & identifiers
- Preferred name
- Ethyl 2-(2-methyl-4-phenyl-1,3-dioxolan-2-yl)acetate
- IUPAC
- ethyl 2-(2-methyl-4-phenyl-1,3-dioxolan-2-yl)acetate
- English name
- Ethyl 2-(2-methyl-4-phenyl-1,3-dioxolan-2-yl)acetate
- Molecular formula
- C14H18O4
- Molecular weight
- 250.29
Names & synonyms
58345-29-2ethyl 2-(2-methyl-4-phenyl-1,3-dioxolan-2-yl)acetateNSC44745DTXSID20973909NSC-44745AKOS024340931Ethyl (2-methyl-4-phenyl-1,3-dioxolan-2-yl)acetate1,3-Dioxolane-2-acetic acid, 2-methyl-4-phenyl-, ethyl ester
Database identifiers
- CAS
58345-29-2- PubChem CID
- 239574
- DTXSID
DTXSID20973909
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Boiling point
- 332.9 · 332.9±27.0 °C(Predicted)
- Density
- 1.1 · 1.100±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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