Ethyl 2-(2,4,6-trimethyl-1,3-dioxan-2-yl)acetate
Basic information
- CAS
6472-11-3- Standard SMILES
CCOC(=O)CC1(C)OC(C)CC(C)O1- InChIKey
NJCFQLIZIBEBKX-UHFFFAOYSA-N- Molecular formula
- C11H20O4
- Average molar mass
- 216.27 g/mol
- Monoisotopic mass
- 216.13615911
Names & identifiers
- Preferred name
- Ethyl 2-(2,4,6-trimethyl-1,3-dioxan-2-yl)acetate
- IUPAC
- ethyl 2-(2,4,6-trimethyl-1,3-dioxan-2-yl)acetate
Names & synonyms
6472-11-3ethyl 2-(2,4,6-trimethyl-1,3-dioxan-2-yl)acetateNSC408704DTXSID90325118NSC-408704DS-008348Ethyl (2,4,6-trimethyl-1,3-dioxan-2-yl)acetate1,3-Dioxane-2-aceticacid, 2,4,6-trimethyl-, ethyl ester
Database identifiers
- CAS
6472-11-3- PubChem CID
- 349129
- DTXSID
DTXSID90325118
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 217
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Compound notes
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