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N-diphenylphosphinoyl-piperazine (HCID 22397667)|Huagongshe
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Compound
N-diphenylphosphinoyl-piperazine
HCID
22397667
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
O=P(c1ccccc1)(c1ccccc1)N1CCNCC1
InChIKey
MFUFZZCZFPTBIL-UHFFFAOYSA-N
Molecular formula
C16H19N2OP
Average molar mass
286.31 g/mol
Monoisotopic mass
286.12350023
Names & identifiers
Preferred name
N-diphenylphosphinoyl-piperazine
IUPAC
1-diphenylphosphorylpiperazine
Names & synonyms
N-diphenylphosphinoyl-piperazine
SCHEMBL6161536
MFUFZZCZFPTBIL-UHFFFAOYSA-N
Database identifiers
PubChem CID
22397667
Properties
Computed structural properties
XLogP
2.1
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
320
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
1070753
As product
uspto-grants-2005_06
HRID
2337618
As product
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Compound notes
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