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852952-20-6 | 2-{[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}benzoic acid
CAS No: 852952-20-6 Catalog No: AG01FGQM MDL No:
Product Description
Catalog Number:
AG01FGQM
Chemical Name:
2-{[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}benzoic acid
CAS Number:
852952-20-6
IUPAC Name:
2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxybenzoic acid
InChI:
InChI=1S/C13H7ClF3NO3/c14-9-5-7(13(15,16)17)6-18-11(9)21-10-4-2-1-3-8(10)12(19)20/h1-6H,(H,19,20)
InChI Key:
SHJBGWACJFQUKQ-UHFFFAOYSA-N
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.007g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.648g/mol
Monoisotopic Mass:
317.007g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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