5-Hexynophenone, 4'-fluoro-2-morpholinomethyl-, hydrochloride
Basic information
- CAS
29229-75-2- Standard SMILES
C#CCCC(C[NH+]1CCOCC1)C(=O)c1ccc(F)cc1.[Cl-]- InChIKey
CUJZTIQIZKZNHN-UHFFFAOYSA-N- Molecular formula
- C17H21ClFNO2
- Average molar mass
- 325.8 g/mol
- Monoisotopic mass
- 325.1244848
Names & identifiers
- Preferred name
- 5-Hexynophenone, 4'-fluoro-2-morpholinomethyl-, hydrochloride
- IUPAC
- 1-(4-fluorophenyl)-2-(morpholin-4-ium-4-ylmethyl)hex-5-yn-1-one chloride
Names & synonyms
4'-Fluoro-2-morpholinomethyl-5-hexynophenone hydrochloride29229-75-25-HEXYNOPHENONE, 4'-FLUORO-2-MORPHOLINOMETHYL-, HYDROCHLORIDERefChem:303326
Database identifiers
- CAS
29229-75-2- PubChem CID
- 34524
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 375
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…