Basic information
- CAS
26964-73-8- Standard SMILES
CCOC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1.Cl- InChIKey
GDJAQJMACITLMM-UHFFFAOYSA-N- Molecular formula
- C17H24ClFN2O3
- Average molar mass
- 358.8 g/mol
- Monoisotopic mass
- 358.1459485
Names & identifiers
- Preferred name
- 1-Piperazinecarboxylic acid, 4-(4-(4-fluorophenyl)-4-oxobutyl)-, ethyl ester, monohydrochloride
- IUPAC
- ethyl 4-[4-(4-fluorophenyl)-4-oxobutyl]piperazine-1-carboxylate;hydrochloride
Names & synonyms
1-Piperazinecarboxylic acid, 4-(4-(4-fluorophenyl)-4-oxobutyl)-, ethyl ester, monohydrochloride26964-73-81-Piperazinecarboxylic acid, 4-(4'-fluoro-butyrophenon-1-yl)-, ethyl ester, hydrochlorideDTXSID401814631-(3-(4-Fluorobenzoyl)propyl)-4-(ethoxycarbonyl)piperazine hydrochloride4-(4'-Fluoro-butyrophenon-1-yl)-1-piperazinecarboxylic acid ethyl ester hydrochloride4-(4-(4-Fluorophenyl)-4-oxobutyl)-1-piperazinecarboxylic acid ethyl ester hydrochlorideRefChem:233639DTXCID50103954ethyl 4-[4-(4-fluorophenyl)-4-oxobutyl]piperazine-1-carboxylate;hydrochlorideAKOS024273910ST001970
Show more names
ethyl 4-[4-(4-fluorophenyl)-4-oxobutyl]piperazinecarboxylate, chlorideEthyl 4-[4-(4-fluorophenyl)-4-oxobutyl]piperazine-1-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
26964-73-8
Properties
Computed structural properties
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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