Home Carboxys 3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-5-carboxylic acid

3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-5-carboxylic acid

CAS No.:
1495681-98-5
Catalog Number:
AG01DLVV
Molecular Formula:
C8H7F3N2O2
Molecular Weight:
220.1486
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$273
- +
250mg
95%
In Stock USA
United States
$483
- +
1g
95%
In Stock USA
United States
$966
- +
Product Description
Catalog Number:
AG01DLVV
Chemical Name:
3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-5-carboxylic acid
CAS Number:
1495681-98-5
Molecular Formula:
C8H7F3N2O2
Molecular Weight:
220.1486
IUPAC Name:
3-(trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-5-carboxylic acid
InChI:
InChI=1S/C8H7F3N2O2/c9-8(10,11)6-4-1-3(7(14)15)2-5(4)12-13-6/h3H,1-2H2,(H,12,13)(H,14,15)
InChI Key:
CXOMAYFHMXUFLD-UHFFFAOYSA-N
SMILES:
OC(=O)C1Cc2c(C1)[nH]nc2C(F)(F)F
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.046g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
220.151g/mol
Monoisotopic Mass:
220.046g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties