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82180-53-8 | Phosphonic acid, [2-phenyl-1-[(phenylmethyl)amino]ethyl]-, diethyl ester
CAS No: 82180-53-8 Catalog No: AG005HWR MDL No:
Product Description
Catalog Number:
AG005HWR
Chemical Name:
Phosphonic acid, [2-phenyl-1-[(phenylmethyl)amino]ethyl]-, diethyl ester
CAS Number:
82180-53-8
Molecular Formula:
C19H26NO3P
Molecular Weight:
347.3884
IUPAC Name:
N-benzyl-1-diethoxyphosphoryl-2-phenylethanamine
InChI:
InChI=1S/C19H26NO3P/c1-3-22-24(21,23-4-2)19(15-17-11-7-5-8-12-17)20-16-18-13-9-6-10-14-18/h5-14,19-20H,3-4,15-16H2,1-2H3
InChI Key:
DNLNOENOKUVJHY-UHFFFAOYSA-N
SMILES:
CCOP(=O)(C(Cc1ccccc1)NCc1ccccc1)OCC
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.165g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
347.395g/mol
Monoisotopic Mass:
347.165g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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