Basic information
- CAS
5631-35-6- Standard SMILES
Fc1ccc(C(CCCN2CCNCC2)c2ccc(F)cc2)cc1- InChIKey
XMRZXPIHMZRNQC-UHFFFAOYSA-N- Molecular formula
- C20H24F2N2
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.1907551
Names & identifiers
- Preferred name
- 1-(4,4-Bis(4-fluorophenyl)butyl)piperazine
- IUPAC
- 1-[4,4-bis(4-fluorophenyl)butyl]piperazine
- English name
- 1-[4,4-bis(4-fluorophenyl)butyl]piperazine
- Molecular formula
- C20H24F2N2
- Molecular weight
- 330.4147664
Names & synonyms
1-[4,4-bis(4-fluorophenyl)butyl]piperazine5631-35-6EINECS 227-070-71-(4,4-Bis(4-fluorophenyl)butyl)piperazineDTXSID90204853RefChem:74366DTXCID20127344227-070-7CHEMBL81206SCHEMBL2268114SCHEMBL11338768AKOS024288394
Show more names
1-[4,4-Di(4-fluorophenyl)butyl]piperazinePiperazine, 1-[4,4-bis(4-fluorophenyl)butyl]-
ST104000[4,4-bis(4-fluorophenyl)butyl]piperazine1-[4,4-bis(p-fluorophenyl)butyl]piperazineNS00044962ST509982691-[4,4-bis(p-fluorophenyl)butyl]-piperazine
Database identifiers
- CAS
5631-35-6- PubChem CID
- 79729
- DTXSID
DTXSID90204853- ChEMBL
CHEMBL81206- EC Number
- 227-070-7
- Nikkaji
- J225.066G
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 322
Chemistry & industry
Suppliers1 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Related reactions
9 records
Compound notes
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