5,5-Dimethyl-2-(6-methylcyclohex-3-en-1-yl)-1,3-dioxane
Basic information
- CAS
6976-75-6- Standard SMILES
CC1CC=CCC1C1OCC(C)(C)CO1- InChIKey
GEVSVFAZIUJFHZ-UHFFFAOYSA-N- Molecular formula
- C13H22O2
- Average molar mass
- 210.31 g/mol
- Monoisotopic mass
- 210.16197994
Names & identifiers
- Preferred name
- 5,5-Dimethyl-2-(6-methylcyclohex-3-en-1-yl)-1,3-dioxane
- IUPAC
- 5,5-dimethyl-2-(6-methylcyclohex-3-en-1-yl)-1,3-dioxane
Names & synonyms
6976-75-65,5-dimethyl-2-(6-methylcyclohex-3-en-1-yl)-1,3-dioxaneNSC24789DTXSID90282171NSC-24789
Database identifiers
- CAS
6976-75-6- PubChem CID
- 230199
- DTXSID
DTXSID90282171
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 235
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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