Home Other Building Blocks 2-Fluoro-5-(trifluoromethyl)benzoic acid

2-Fluoro-5-(trifluoromethyl)benzoic acid

CAS No.:
115029-23-7
Catalog Number:
AG000FQY
Molecular Formula:
C8H4F4O2
Molecular Weight:
208.1098
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$19
- +
25g
97%
In Stock USA
United States
$75
- +
100g
97%
In Stock USA
United States
$188
- +
500g
97%
In Stock USA
United States
$813
- +
Product Description
Catalog Number:
AG000FQY
Chemical Name:
2-Fluoro-5-(trifluoromethyl)benzoic acid
CAS Number:
115029-23-7
Molecular Formula:
C8H4F4O2
Molecular Weight:
208.1098
MDL Number:
MFCD00061292
IUPAC Name:
2-fluoro-5-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C8H4F4O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14)
InChI Key:
LIFKXWNFWIUMJT-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(ccc1F)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:
208.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.112g/mol
Monoisotopic Mass:
208.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties