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Home Other Building Blocks 2,3,4,5,6-Pentafluorophenylacetic acid

2,3,4,5,6-Pentafluorophenylacetic acid

CAS No.:
653-21-4
Catalog Number:
AG003FD6
Molecular Formula:
C8H3F5O2
Molecular Weight:
226.1002
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$32
- +
5g
95%
In Stock USA
United States
$94
- +
25g
95%
In Stock USA
United States
$369
- +
Product Description
Catalog Number:
AG003FD6
Chemical Name:
2,3,4,5,6-Pentafluorophenylacetic acid
CAS Number:
653-21-4
Molecular Formula:
C8H3F5O2
Molecular Weight:
226.1002
MDL Number:
MFCD00004316
IUPAC Name:
2-(2,3,4,5,6-pentafluorophenyl)acetic acid
InChI:
InChI=1S/C8H3F5O2/c9-4-2(1-3(14)15)5(10)7(12)8(13)6(4)11/h1H2,(H,14,15)
InChI Key:
LGCODSNZJOVMHV-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(F)c(F)c(c(c1F)F)F
EC Number:
211-497-0
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.005g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.102g/mol
Monoisotopic Mass:
226.005g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties