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

4-(4-Trifluoromethoxyphenyl)benzoic acid

CAS No.:
728919-11-7
Catalog Number:
AG00FB8J
Molecular Formula:
C14H9F3O3
Molecular Weight:
282.2147
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00FB8J
Chemical Name:
4-(4-Trifluoromethoxyphenyl)benzoic acid
CAS Number:
728919-11-7
Molecular Formula:
C14H9F3O3
Molecular Weight:
282.2147
MDL Number:
MFCD04117415
IUPAC Name:
4-[4-(trifluoromethoxy)phenyl]benzoic acid
InChI:
InChI=1S/C14H9F3O3/c15-14(16,17)20-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(18)19/h1-8H,(H,18,19)
InChI Key:
YZWGBLHLQLDTMZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)c1ccc(cc1)OC(F)(F)F
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.05g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
282.218g/mol
Monoisotopic Mass:
282.05g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties