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88350-63-4 | Ethanone, 2-(4-chlorophenoxy)-2-[(5-chloro-2-pyrimidinyl)oxy]-1-phenyl-
CAS No: 88350-63-4 Catalog No: AG004760 MDL No:
Product Description
Catalog Number:
AG004760
Chemical Name:
Ethanone, 2-(4-chlorophenoxy)-2-[(5-chloro-2-pyrimidinyl)oxy]-1-phenyl-
CAS Number:
88350-63-4
Molecular Formula:
C18H12Cl2N2O3
Molecular Weight:
375.2055
IUPAC Name:
2-(4-chlorophenoxy)-2-(5-chloropyrimidin-2-yl)oxy-1-phenylethanone
InChI:
InChI=1S/C18H12Cl2N2O3/c19-13-6-8-15(9-7-13)24-17(16(23)12-4-2-1-3-5-12)25-18-21-10-14(20)11-22-18/h1-11,17H
InChI Key:
VUAVECVTIBLULA-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)OC(C(=O)c1ccccc1)Oc1ncc(cn1)Cl
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.022g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.205g/mol
Monoisotopic Mass:
374.022g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
61.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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