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Home Other Building Blocks 3-(4-Methoxyphenyl)-5-trifluoromethylbenzoic acid

3-(4-Methoxyphenyl)-5-trifluoromethylbenzoic acid

CAS No.:
1261902-93-5
Catalog Number:
AG000S4B
Molecular Formula:
C15H11F3O3
Molecular Weight:
296.2412
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG000S4B
Chemical Name:
3-(4-Methoxyphenyl)-5-trifluoromethylbenzoic acid
CAS Number:
1261902-93-5
Molecular Formula:
C15H11F3O3
Molecular Weight:
296.2412
MDL Number:
MFCD18319534
IUPAC Name:
3-(4-methoxyphenyl)-5-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C15H11F3O3/c1-21-13-4-2-9(3-5-13)10-6-11(14(19)20)8-12(7-10)15(16,17)18/h2-8H,1H3,(H,19,20)
InChI Key:
CJIXZYYEHIKXJX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cc(cc(c1)C(F)(F)F)C(=O)O
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.066g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.245g/mol
Monoisotopic Mass:
296.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties