methyl 2-(2,2-dimethyltetrahydro-2H-pyran-4-yl)acetate
Basic information
- CAS
306325-99-5- Standard SMILES
COC(=O)CC1CCOC(C)(C)C1- InChIKey
MXVBCRXQXNOQBQ-UHFFFAOYSA-N- Molecular formula
- C10H18O3
- Average molar mass
- 186.25 g/mol
- Monoisotopic mass
- 186.12559443
Names & identifiers
- Preferred name
- methyl 2-(2,2-dimethyltetrahydro-2H-pyran-4-yl)acetate
- IUPAC
- methyl 2-(2,2-dimethyloxan-4-yl)acetate
Names & synonyms
methyl 2-(2,2-dimethyltetrahydro-2H-pyran-4-yl)acetate306325-99-5methyl 2-(2,2-dimethyloxan-4-yl)acetateSCHEMBL1965916STL372806AKOS006273395CS-0364313methyl (2,2-dimethyltetrahydro-2H-pyran-4-yl)acetate
Database identifiers
- CAS
306325-99-5- PubChem CID
- 3766643
- EC Number
- 191-499-5
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 187
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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