Home Other Building Blocks 3-[2-(Trifluoromethyl)phenyl]propanoic acid

3-[2-(Trifluoromethyl)phenyl]propanoic acid

CAS No.:
94022-99-8
Catalog Number:
AG0033K9
Molecular Formula:
C10H9F3O2
Molecular Weight:
218.1725
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$63
- +
10g
98%
In Stock USA
United States
$100
- +
25g
98%
In Stock USA
United States
$150
- +
100g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG0033K9
Chemical Name:
3-[2-(Trifluoromethyl)phenyl]propanoic acid
CAS Number:
94022-99-8
Molecular Formula:
C10H9F3O2
Molecular Weight:
218.1725
MDL Number:
MFCD06823965
IUPAC Name:
3-[2-(trifluoromethyl)phenyl]propanoic acid
InChI:
InChI=1S/C10H9F3O2/c11-10(12,13)8-4-2-1-3-7(8)5-6-9(14)15/h1-4H,5-6H2,(H,14,15)
InChI Key:
YTDVNFDGHHHPEE-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccccc1C(F)(F)F
EC Number:
301-594-7
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.055g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.175g/mol
Monoisotopic Mass:
218.055g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties