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Home Other Building Blocks 4-(4-Trifluoromethylphenyl)benzoic acid

4-(4-Trifluoromethylphenyl)benzoic acid

CAS No.:
195457-71-7
Catalog Number:
AG003877
Molecular Formula:
C14H9F3O2
Molecular Weight:
266.2153
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$242
- +
10g
98%
In Stock USA
United States
$415
- +
25g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG003877
Chemical Name:
4-(4-Trifluoromethylphenyl)benzoic acid
CAS Number:
195457-71-7
Molecular Formula:
C14H9F3O2
Molecular Weight:
266.2153
MDL Number:
MFCD03424606
IUPAC Name:
4-[4-(trifluoromethyl)phenyl]benzoic acid
InChI:
InChI=1S/C14H9F3O2/c15-14(16,17)12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(18)19/h1-8H,(H,18,19)
InChI Key:
JXOFQKVEGRNGLD-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.055g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
266.219g/mol
Monoisotopic Mass:
266.055g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Literature
Title Journal
Novel ATP-competitive kinesin spindle protein inhibitors. Journal of medicinal chemistry 20071004
Properties