Methanone, (4-chlorophenyl)[4-(4-fluorophenyl)-1-piperazinyl]-
Basic information
- CAS
328262-14-2- Standard SMILES
O=C(c1ccc(Cl)cc1)N1CCN(c2ccc(F)cc2)CC1- InChIKey
NZFSITISISONCP-UHFFFAOYSA-N- Molecular formula
- C17H16ClFN2O
- Average molar mass
- 318.8 g/mol
- Monoisotopic mass
- 318.093519
Names & identifiers
- Preferred name
- Methanone, (4-chlorophenyl)[4-(4-fluorophenyl)-1-piperazinyl]-
- IUPAC
- (4-chlorophenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone
- English name
- 1-(4-chlorobenzoyl)-4-(4-fluorophenyl)piperazine
- Molecular formula
- C17H16ClFN2O
- Molecular weight
- 318.7731432
Names & synonyms
328262-14-2Methanone, (4-chlorophenyl)[4-(4-fluorophenyl)-1-piperazinyl]-Methanone, (4-chlorophenyl)(4-(4-fluorophenyl)-1-piperazinyl)-RefChem:3526971-(4-chlorobenzoyl)-4-(4-fluorophenyl)piperazine(4-chlorophenyl)[4-(4-fluorophenyl)piperazin-1-yl]methanone(4-Chlorophenyl)(4-(4-fluorophenyl)piperazin-1-yl)methanone(4-Chloro-phenyl)-[4-(4-fluoro-phenyl)-piperazin-1-yl]-methanone(4-CHLORO-PHENYL)-(4-(4-FLUORO-PHENYL)-PIPERAZIN-1-YL)-METHANONESMR000116653CBMicro_048306Oprea1_627254
Show more names
Oprea1_636796MLS000526179CHEMBL1716672(4-chlorophenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanoneDTXSID201178939HMS2507C04STK011758AKOS000671435
Database identifiers
- CAS
328262-14-2- PubChem CID
- 720118
- DTXSID
DTXSID201178939- ChEMBL
CHEMBL1716672- EC Number
- 164-418-6
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 371
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
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Related reactions
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Compound notes
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