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Basic information
- CAS
157524-21-5- Standard SMILES
CCOP(=O)(Cc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1)OCC- InChIKey
UYHITTYDLWDQLB-UHFFFAOYSA-N- Molecular formula
- C23H33N2O3P
- Average molar mass
- 416.502 g/mol
- Monoisotopic mass
- 416.22287955
Names & identifiers
- Preferred name
- Diethyl benzylpiperazinomethylbenzylphosphonate
- IUPAC
- Diethyl ({4-[(4-benzylpiperazin-1-yl)methyl]phenyl}methyl)phosphonate
- English name
- diethyl benzylpiperazinomethylbenzylphosphonate
- Molecular formula
- C23H33N2O3P
- Molecular weight
- 416.49
Names & synonyms
diethyl benzylpiperazinomethylbenzylphosphonatePhosphonic acid, [[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]methyl]-, diethyl ester (9CI)
Database identifiers
- CAS
157524-21-5- PubChem CID
- 190879
- DTXSID
DTXSID60166277
Properties
Physicochemical properties
- Boiling point
- 531.58 · 531.580±50.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.143 · 1.143±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 6.776 · 6.776±0.10(predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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