Basic information
- CAS
101418-12-6- Standard SMILES
CCOC(=O)OC1CN2CCC1CC2- InChIKey
AEHHEWLGTKWBQI-UHFFFAOYSA-N- Molecular formula
- C10H17NO3
- Average molar mass
- 199.25 g/mol
- Monoisotopic mass
- 199.1208434
Names & identifiers
- Preferred name
- Carbonic acid, ethyl 3-quinuclidinyl ester
- IUPAC
- 1-azabicyclo[2.2.2]octan-3-yl ethyl carbonate
Names & synonyms
Ethyl 3-quinuclidinyl carbonate101418-12-6CARBONIC ACID, ETHYL 3-QUINUCLIDINYL ESTERRefChem:3333941-azabicyclo[2.2.2]octan-3-yl ethyl carbonateDTXSID10906160
Database identifiers
- CAS
101418-12-6- PubChem CID
- 58321
- DTXSID
DTXSID10906160- Nikkaji
- J68.721I
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 211
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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