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863288-28-2 | Benzenamine, 2,2'-[1,3-phenylenebis(oxy)]bis[5-chloro-
CAS No: 863288-28-2 Catalog No: AG004RIE MDL No:
Product Description
Catalog Number:
AG004RIE
Chemical Name:
Benzenamine, 2,2'-[1,3-phenylenebis(oxy)]bis[5-chloro-
CAS Number:
863288-28-2
Molecular Formula:
C18H14Cl2N2O2
Molecular Weight:
361.2220
IUPAC Name:
2-[3-(2-amino-4-chlorophenoxy)phenoxy]-5-chloroaniline
InChI:
InChI=1S/C18H14Cl2N2O2/c19-11-4-6-17(15(21)8-11)23-13-2-1-3-14(10-13)24-18-7-5-12(20)9-16(18)22/h1-10H,21-22H2
InChI Key:
RXDXBYFYXALUME-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)N)Oc1cccc(c1)Oc1ccc(cc1N)Cl
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.043g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
361.222g/mol
Monoisotopic Mass:
360.043g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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