Home Other Building Blocks 3-[4-(Trifluoromethyl)phenyl]prop-2-ynoic acid

3-[4-(Trifluoromethyl)phenyl]prop-2-ynoic acid

CAS No.:
3792-88-9
Catalog Number:
AG01BDF6
Molecular Formula:
C10H5F3O2
Molecular Weight:
214.1407
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$177
- +
Product Description
Catalog Number:
AG01BDF6
Chemical Name:
3-[4-(Trifluoromethyl)phenyl]prop-2-ynoic acid
CAS Number:
3792-88-9
Molecular Formula:
C10H5F3O2
Molecular Weight:
214.1407
MDL Number:
MFCD18853578
IUPAC Name:
3-[4-(trifluoromethyl)phenyl]prop-2-ynoic acid
InChI:
InChI=1S/C10H5F3O2/c11-10(12,13)8-4-1-7(2-5-8)3-6-9(14)15/h1-2,4-5H,(H,14,15)
InChI Key:
XOCLMGDPIQZXDW-UHFFFAOYSA-N
SMILES:
OC(=O)C#Cc1ccc(cc1)C(F)(F)F
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.024g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.143g/mol
Monoisotopic Mass:
214.024g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties