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Home > Fluorides > 1706435-08-6
1706435-08-6 | 2-Fluoro-5-methyl-3-(trifluoromethyl)benzoic acid
CAS No: 1706435-08-6 Catalog No: AG01FGNT MDL No:
Product Description
Catalog Number:
AG01FGNT
Chemical Name:
2-Fluoro-5-methyl-3-(trifluoromethyl)benzoic acid
CAS Number:
1706435-08-6
IUPAC Name:
2-fluoro-5-methyl-3-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C9H6F4O2/c1-4-2-5(8(14)15)7(10)6(3-4)9(11,12)13/h2-3H,1H3,(H,14,15)
InChI Key:
GJIOQLSHHHOUPD-UHFFFAOYSA-N
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.03g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.139g/mol
Monoisotopic Mass:
222.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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