Home Other Building Blocks Phosphonic acid, P-[(6-Methyl-2-pyridinyl)(phenylaMino)Methyl]-, diphenyl ester

Phosphonic acid, P-[(6-Methyl-2-pyridinyl)(phenylaMino)Methyl]-, diphenyl ester

CAS No.:
614750-85-5
Catalog Number:
AG00EL1X
Molecular Formula:
C25H23N2O3P
Molecular Weight:
430.4355
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Product Description
Catalog Number:
AG00EL1X
Chemical Name:
Phosphonic acid, P-[(6-Methyl-2-pyridinyl)(phenylaMino)Methyl]-, diphenyl ester
CAS Number:
614750-85-5
Molecular Formula:
C25H23N2O3P
Molecular Weight:
430.4355
MDL Number:
MFCD18632870
IUPAC Name:
N-[diphenoxyphosphoryl-(6-methylpyridin-2-yl)methyl]aniline
InChI:
InChI=1S/C25H23N2O3P/c1-20-12-11-19-24(26-20)25(27-21-13-5-2-6-14-21)31(28,29-22-15-7-3-8-16-22)30-23-17-9-4-10-18-23/h2-19,25,27H,1H3
InChI Key:
CXKJPVJQTPRXRT-UHFFFAOYSA-N
SMILES:
Cc1cccc(n1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1ccccc1
Properties
Complexity:
547  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
430.145g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
430.444g/mol
Monoisotopic Mass:
430.145g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8  
Properties