Basic information
- CAS
187220-44-6- Standard SMILES
CC1(C)COC2(CCCC(=O)C2)OC1- InChIKey
NHFVEBWIBVLQKP-UHFFFAOYSA-N- Molecular formula
- C11H18O3
- Average molar mass
- 198.26 g/mol
- Monoisotopic mass
- 198.12559444
Names & identifiers
- Preferred name
- 3,3-Dimethyl-1,5-dioxaspiro[5.5]undecan-8-one
- IUPAC
- 3,3-dimethyl-1,5-dioxaspiro[5.5]undecan-10-one
Names & synonyms
187220-44-63,3-DIMETHYL-1,5-DIOXASPIRO[5.5]UNDECAN-8-ONE3,3-dimethyl-1,5-dioxa-spiro[5,5]undecan-8-oneSCHEMBL6293004DTXSID90571779NHFVEBWIBVLQKP-UHFFFAOYSA-N3,3-dimethyl-1,5-dioxa-spiro[5,5] undecan-8-one3,3-dimethyl-1,5-dioxa-spiro[5.5]undecan-8-one
Database identifiers
- CAS
187220-44-6- PubChem CID
- 15344749
- DTXSID
DTXSID90571779- EC Number
- 606-105-3
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 235
Related reactions
5 records
Compound notes
Loading…