Home Other Building Blocks 2,3,5-Trifluoro-4-methylbenzoic acid

2,3,5-Trifluoro-4-methylbenzoic acid

CAS No.:
773869-50-4
Catalog Number:
AG003FF9
Molecular Formula:
C8H5F3O2
Molecular Weight:
190.1193
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97%
In Stock USA
United States
$228
- +
Product Description
Catalog Number:
AG003FF9
Chemical Name:
2,3,5-Trifluoro-4-methylbenzoic acid
CAS Number:
773869-50-4
Molecular Formula:
C8H5F3O2
Molecular Weight:
190.1193
MDL Number:
MFCD00456800
IUPAC Name:
2,3,5-trifluoro-4-methylbenzoic acid
InChI:
InChI=1S/C8H5F3O2/c1-3-5(9)2-4(8(12)13)7(11)6(3)10/h2H,1H3,(H,12,13)
InChI Key:
BLYIPGURQKHLOM-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(F)c(c(c1F)F)C
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.024g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.121g/mol
Monoisotopic Mass:
190.024g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties