Home Carboxys 5-Trifluoromethyl-1H-indole-2-carboxylic acid

5-Trifluoromethyl-1H-indole-2-carboxylic acid

CAS No.:
496946-78-2
Catalog Number:
AG006YX5
Molecular Formula:
C10H6F3NO2
Molecular Weight:
229.1553
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$188
- +
1g
98%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG006YX5
Chemical Name:
5-Trifluoromethyl-1H-indole-2-carboxylic acid
CAS Number:
496946-78-2
Molecular Formula:
C10H6F3NO2
Molecular Weight:
229.1553
MDL Number:
MFCD03095229
IUPAC Name:
5-(trifluoromethyl)-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C10H6F3NO2/c11-10(12,13)6-1-2-7-5(3-6)4-8(14-7)9(15)16/h1-4,14H,(H,15,16)
InChI Key:
FYRRCNKOGMDNSI-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([nH]1)ccc(c2)C(F)(F)F
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.035g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
229.158g/mol
Monoisotopic Mass:
229.035g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties