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3-(2-Diphenylphosphorylethylamino)-3,3-diphenylpropanenitrile

HCID 311920
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Basic information

CAS
32247-24-8
Standard SMILES
N#CCC(NCCP(=O)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIKey
UQZQUMXYTPUVLD-UHFFFAOYSA-N
Molecular formula
C29H27N2OP
Average molar mass
450.5 g/mol
Monoisotopic mass
450.18610049

Names & identifiers

Preferred name
3-(2-Diphenylphosphorylethylamino)-3,3-diphenylpropanenitrile
IUPAC
3-(2-diphenylphosphorylethylamino)-3,3-diphenylpropanenitrile

Names & synonyms

32247-24-8NSC2192493-(2-diphenylphosphorylethylamino)-3,3-diphenylpropanenitrileDTXSID20309906NSC-2192493-{[2-(Diphenylphosphoryl)ethyl]amino}-3,3-diphenylpropanenitrile

Database identifiers

CAS
32247-24-8
PubChem CID
311920
DTXSID
DTXSID20309906

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
52.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
33
Formal charge
0
Complexity
633

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