Home Other Building Blocks 2,3,6-Trifluorophenylacetic acid

2,3,6-Trifluorophenylacetic acid

CAS No.:
114152-23-7
Catalog Number:
AG000AO8
Molecular Formula:
C8H5F3O2
Molecular Weight:
190.1193
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$22
- +
5g
95%
In Stock USA
United States
$100
- +
10g
95%
In Stock USA
United States
$188
- +
25g
98%
In Stock USA
United States
$382
- +
Product Description
Catalog Number:
AG000AO8
Chemical Name:
2,3,6-Trifluorophenylacetic acid
CAS Number:
114152-23-7
Molecular Formula:
C8H5F3O2
Molecular Weight:
190.1193
MDL Number:
MFCD00061217
IUPAC Name:
2-(2,3,6-trifluorophenyl)acetic acid
InChI:
InChI=1S/C8H5F3O2/c9-5-1-2-6(10)8(11)4(5)3-7(12)13/h1-2H,3H2,(H,12,13)
InChI Key:
QRAZASHLGLHKEB-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(F)ccc(c1F)F
Properties
Complexity:
198  
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:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties