sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 4,4,4-Trifluoro-3-hydroxy-3-(trifluoromethyl)butanoic acid

4,4,4-Trifluoro-3-hydroxy-3-(trifluoromethyl)butanoic acid

CAS No.:
1547-36-0
Catalog Number:
AG003ICI
Molecular Formula:
C5H4F6O3
Molecular Weight:
226.0739
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$85
- +
5g
97%
In Stock USA
United States
$171
- +
25g
97%
In Stock USA
United States
$407
- +
100g
97%
In Stock USA
United States
$1204
- +
Product Description
Catalog Number:
AG003ICI
Chemical Name:
4,4,4-Trifluoro-3-hydroxy-3-(trifluoromethyl)butanoic acid
CAS Number:
1547-36-0
Molecular Formula:
C5H4F6O3
Molecular Weight:
226.0739
MDL Number:
MFCD00040910
IUPAC Name:
4,4,4-trifluoro-3-hydroxy-3-(trifluoromethyl)butanoic acid
InChI:
InChI=1S/C5H4F6O3/c6-4(7,8)3(14,1-2(12)13)5(9,10)11/h14H,1H2,(H,12,13)
InChI Key:
NOHJBOWARMTILE-UHFFFAOYSA-N
SMILES:
OC(=O)CC(C(F)(F)F)(C(F)(F)F)O
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.006g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
226.074g/mol
Monoisotopic Mass:
226.006g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties