2,4,8,10-Tetramethyl-3,9-dioxapentacyclo[6.4.0.02,7.04,11.05,10]dodecan-6-ol
Basic information
- CAS
93570-87-7- Standard SMILES
CC12OC3(C)C4CC1C1(C)OC4(C)C3C(O)C21- InChIKey
RZASRCWIRLBRRT-UHFFFAOYSA-N- Molecular formula
- C14H20O3
- Average molar mass
- 236.31 g/mol
- Monoisotopic mass
- 236.1412445
Names & identifiers
- Preferred name
- 2,4,8,10-Tetramethyl-3,9-dioxapentacyclo[6.4.0.02,7.04,11.05,10]dodecan-6-ol
- IUPAC
- 2,4,8,10-tetramethyl-3,9-dioxapentacyclo[6.4.0.02,7.04,11.05,10]dodecan-6-ol
Names & synonyms
93570-87-72,4,8,10-tetramethyl-3,9-dioxapentacyclo[6.4.0.02,7.04,11.05,10]dodecan-6-olNSC140370DTXSID10301010NSC-1403702,4,8,10-Tetramethyl-3,9-dioxapentacyclo[6.4.0.0~2,7~.0~4,11~.0~5,10~]dodecan-6-ol
Database identifiers
- CAS
93570-87-7- PubChem CID
- 284529
- DTXSID
DTXSID10301010
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 392
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…