Home Carboxys 3-Methyl-1-p-tolyl-1h-pyrazole-5-carboxylic acid

3-Methyl-1-p-tolyl-1h-pyrazole-5-carboxylic acid

CAS No.:
885-46-1
Catalog Number:
AG00GVRI
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
10g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00GVRI
Chemical Name:
3-Methyl-1-p-tolyl-1h-pyrazole-5-carboxylic acid
CAS Number:
885-46-1
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
MDL Number:
MFCD05150584
IUPAC Name:
5-methyl-2-(4-methylphenyl)pyrazole-3-carboxylic acid
InChI:
InChI=1S/C12H12N2O2/c1-8-3-5-10(6-4-8)14-11(12(15)16)7-9(2)13-14/h3-7H,1-2H3,(H,15,16)
InChI Key:
LKRSFZWSZCSMOZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)n1nc(cc1C(=O)O)C
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties