Home Other Building Blocks 3-(Trifluoromethoxy)hydrocinnamic acid

3-(Trifluoromethoxy)hydrocinnamic acid

CAS No.:
168833-77-0
Catalog Number:
AG003BAH
Molecular Formula:
C10H9F3O3
Molecular Weight:
234.1719
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$67
- +
Product Description
Catalog Number:
AG003BAH
Chemical Name:
3-(Trifluoromethoxy)hydrocinnamic acid
CAS Number:
168833-77-0
Molecular Formula:
C10H9F3O3
Molecular Weight:
234.1719
MDL Number:
MFCD01317834
IUPAC Name:
3-[3-(trifluoromethoxy)phenyl]propanoic acid
InChI:
InChI=1S/C10H9F3O3/c11-10(12,13)16-8-3-1-2-7(6-8)4-5-9(14)15/h1-3,6H,4-5H2,(H,14,15)
InChI Key:
WGEVFUNNEITJFQ-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1cccc(c1)OC(F)(F)F
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.05g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.174g/mol
Monoisotopic Mass:
234.05g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties