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84044-04-2 | Phosphonic acid, (aminophenylmethyl)-, diphenyl ester
CAS No: 84044-04-2 Catalog No: AG004U62 MDL No:
Product Description
Catalog Number:
AG004U62
Chemical Name:
Phosphonic acid, (aminophenylmethyl)-, diphenyl ester
CAS Number:
84044-04-2
Molecular Formula:
C19H18NO3P
Molecular Weight:
339.3249
IUPAC Name:
diphenoxyphosphoryl(phenyl)methanamine
InChI:
InChI=1S/C19H18NO3P/c20-19(16-10-4-1-5-11-16)24(21,22-17-12-6-2-7-13-17)23-18-14-8-3-9-15-18/h1-15,19H,20H2
InChI Key:
ADKWGDVIVQQVIQ-UHFFFAOYSA-N
SMILES:
NC(P(=O)(Oc1ccccc1)Oc1ccccc1)c1ccccc1
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.102g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
339.331g/mol
Monoisotopic Mass:
339.102g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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