Basic information
- CAS
84344-65-0- Standard SMILES
O=Cc1ccc(OCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1- InChIKey
BENHOCSWVAGQEL-UHFFFAOYSA-N- Molecular formula
- C21H23F3N2O2
- Average molar mass
- 392.4 g/mol
- Monoisotopic mass
- 392.17116247
Names & identifiers
- Preferred name
- Benzaldehyde, 4-(3-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)propoxy)-
- IUPAC
- 4-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propoxy]benzaldehyde
Names & synonyms
BRN 456815884344-65-0BENZALDEHYDE, 4-(3-(4-(3-(TRIFLUOROMETHYL)PHENYL)-1-PIPERAZINYL)PROPOXY)-DTXSID402333354-(3-(4-(3-(Trifluoromethyl)phenyl)-1-piperazinyl)propoxy)benzaldehydeRefChem:321190DTXCID401558264-(3-{4-[3-(Trifluoromethyl)phenyl]piperazin-1-yl}propoxy)benzaldehyde
Database identifiers
- CAS
84344-65-0- PubChem CID
- 55243
- DTXSID
DTXSID40233335
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 473
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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