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142209-23-2 | Phosphoric acid, (2,6-dichlorophenyl)methyl diphenyl ester
CAS No: 142209-23-2 Catalog No: AG001HYS MDL No:
Product Description
Catalog Number:
AG001HYS
Chemical Name:
Phosphoric acid, (2,6-dichlorophenyl)methyl diphenyl ester
CAS Number:
142209-23-2
Molecular Formula:
C19H15Cl2O4P
Molecular Weight:
409.1998
IUPAC Name:
(2,6-dichlorophenyl)methyl diphenyl phosphate
InChI:
InChI=1S/C19H15Cl2O4P/c20-18-12-7-13-19(21)17(18)14-23-26(22,24-15-8-3-1-4-9-15)25-16-10-5-2-6-11-16/h1-13H,14H2
InChI Key:
ODAHFKLFCQBEPZ-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1COP(=O)(Oc1ccccc1)Oc1ccccc1)Cl
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.009g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
409.199g/mol
Monoisotopic Mass:
408.009g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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