Basic information
- CAS
67227-26-3- Standard SMILES
O=C(OCCc1cc[nH+]cc1)C1c2ccccc2-c2ccccc21.[Cl-]- InChIKey
KFJABDJIVLTARG-UHFFFAOYSA-N- Molecular formula
- C21H18ClNO2
- Average molar mass
- 351.8 g/mol
- Monoisotopic mass
- 351.1026065
Names & identifiers
- Preferred name
- 2-(Pyridin-4-yl)ethyl 9H-fluorene-9-carboxylate--hydrogen chloride (1/1)
- IUPAC
- 2-pyridin-1-ium-4-ylethyl 9H-fluorene-9-carboxylate chloride
Names & synonyms
67227-26-3DTXSID609863512-(Pyridin-4-yl)ethyl 9H-fluorene-9-carboxylate--hydrogen chloride (1/1)RefChem:1062043DTXCID201413535FLUORENE-9-CARBOXYLIC ACID, 2-(4-PYRIDYL)ETHYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
67227-26-3- PubChem CID
- 49640
Properties
Computed structural properties
- Topological polar surface area
- 40.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 410
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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