Basic information
- CAS
76735-21-2- Standard SMILES
CC1(C)O[C@]2(C)CC[C@@H]1[C@@H](O)[C@@H]2N1CCOCC1- InChIKey
KVVRWJSJKXCRTD-NRWUCQMLSA-N- Molecular formula
- C14H25NO3
- Average molar mass
- 255.35 g/mol
- Monoisotopic mass
- 255.18344366
Names & identifiers
- Preferred name
- (1R,4R,5R,6S)-1,3,3-trimethyl-6-morpholin-4-yl-2-oxabicyclo[2.2.2]octan-5-ol
- IUPAC
- (1R,4R,5R,6S)-1,3,3-trimethyl-6-morpholin-4-yl-2-oxabicyclo[2.2.2]octan-5-ol
Names & synonyms
NSC34136476735-21-2DTXSID20319181NSC-341364(1R,4R,5R,6S)-1,3,3-Trimethyl-6-(morpholin-4-yl)-2-oxabicyclo[2.2.2]octan-5-ol
Database identifiers
- CAS
76735-21-2- PubChem CID
- 334763
- DTXSID
DTXSID20319181
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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