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87170-48-7 | 4-Chloro-3-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)oxy)aniline
CAS No: 87170-48-7 Catalog No: AG004KDM MDL No:MFCD22200381
Product Description
Catalog Number:
AG004KDM
Chemical Name:
4-Chloro-3-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)oxy)aniline
CAS Number:
87170-48-7
Molecular Formula:
C12H7Cl2F3N2O
Molecular Weight:
323.0980
MDL Number:
MFCD22200381
IUPAC Name:
4-chloro-3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyaniline
InChI:
InChI=1S/C12H7Cl2F3N2O/c13-8-2-1-7(18)4-10(8)20-11-9(14)3-6(5-19-11)12(15,16)17/h1-5H,18H2
InChI Key:
NMLZNVAMLNUCOY-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)Oc1ncc(cc1Cl)C(F)(F)F)Cl
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.989g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
323.096g/mol
Monoisotopic Mass:
321.989g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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