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Home Other Building Blocks 3-hydroxy-4-(trifluoromethyl)benzoic acid

3-hydroxy-4-(trifluoromethyl)benzoic acid

CAS No.:
126541-87-5
Catalog Number:
AG000SWK
Molecular Formula:
C8H5F3O3
Molecular Weight:
206.1187
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$188
- +
1g
95%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG000SWK
Chemical Name:
3-hydroxy-4-(trifluoromethyl)benzoic acid
CAS Number:
126541-87-5
Molecular Formula:
C8H5F3O3
Molecular Weight:
206.1187
MDL Number:
MFCD16999826
IUPAC Name:
3-hydroxy-4-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C8H5F3O3/c9-8(10,11)5-2-1-4(7(13)14)3-6(5)12/h1-3,12H,(H,13,14)
InChI Key:
ZZSMIPAVTZJPHQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)O)C(F)(F)F
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.019g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.12g/mol
Monoisotopic Mass:
206.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Bioequivalence of two oral formulations of triflusal capsules in healthy volunteers. Arzneimittel-Forschung 20080101
Effects of triflusal and aspirin in a rat model of cerebral ischemia. Stroke 20070201
Properties