Home Carboxys 3,5-Dimethyl-1-(tetrahydro-2h-pyran-4-yl)-1h-pyrazole-4-carboxylic acid

3,5-Dimethyl-1-(tetrahydro-2h-pyran-4-yl)-1h-pyrazole-4-carboxylic acid

CAS No.:
1342464-27-0
Catalog Number:
AG01B74F
Molecular Formula:
C11H16N2O3
Molecular Weight:
224.2563
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$330
- +
Product Description
Catalog Number:
AG01B74F
Chemical Name:
3,5-Dimethyl-1-(tetrahydro-2h-pyran-4-yl)-1h-pyrazole-4-carboxylic acid
CAS Number:
1342464-27-0
Molecular Formula:
C11H16N2O3
Molecular Weight:
224.2563
MDL Number:
MFCD19611566
IUPAC Name:
3,5-dimethyl-1-(oxan-4-yl)pyrazole-4-carboxylic acid
InChI:
InChI=1S/C11H16N2O3/c1-7-10(11(14)15)8(2)13(12-7)9-3-5-16-6-4-9/h9H,3-6H2,1-2H3,(H,14,15)
InChI Key:
OXLQZJMKYWSCAN-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(C)nn(c1C)C1CCOCC1
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.116g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.26g/mol
Monoisotopic Mass:
224.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties