Home Other Building Blocks 3-(3,5-Difluorophenyl)-5-trifluoromethylbenzoic acid

3-(3,5-Difluorophenyl)-5-trifluoromethylbenzoic acid

CAS No.:
1261950-34-8
Catalog Number:
AG000S91
Molecular Formula:
C14H7F5O2
Molecular Weight:
302.1962
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$300
- +
10g
98%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG000S91
Chemical Name:
3-(3,5-Difluorophenyl)-5-trifluoromethylbenzoic acid
CAS Number:
1261950-34-8
Molecular Formula:
C14H7F5O2
Molecular Weight:
302.1962
MDL Number:
MFCD18320000
IUPAC Name:
3-(3,5-difluorophenyl)-5-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C14H7F5O2/c15-11-4-8(5-12(16)6-11)7-1-9(13(20)21)3-10(2-7)14(17,18)19/h1-6H,(H,20,21)
InChI Key:
CDMSKBIJHRCOGS-UHFFFAOYSA-N
SMILES:
Fc1cc(F)cc(c1)c1cc(cc(c1)C(F)(F)F)C(=O)O
Properties
Complexity:
374  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.037g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
302.2g/mol
Monoisotopic Mass:
302.037g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties