Home Carboxys 4-Methylpyrazole-3-carboxylic acid

4-Methylpyrazole-3-carboxylic acid

CAS No.:
82231-51-4
Catalog Number:
AG003LSK
Molecular Formula:
C5H6N2O2
Molecular Weight:
126.1133
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$107
- +
5g
98%
In Stock USA
United States
$332
- +
10g
98%
In Stock USA
United States
$525
- +
25g
98%
In Stock USA
United States
$1063
- +
Product Description
Catalog Number:
AG003LSK
Chemical Name:
4-Methylpyrazole-3-carboxylic acid
CAS Number:
82231-51-4
Molecular Formula:
C5H6N2O2
Molecular Weight:
126.1133
MDL Number:
MFCD16495896
IUPAC Name:
4-methyl-1H-pyrazole-5-carboxylic acid
InChI:
InChI=1S/C5H6N2O2/c1-3-2-6-7-4(3)5(8)9/h2H,1H3,(H,6,7)(H,8,9)
InChI Key:
FNHVVMJBCILJGA-UHFFFAOYSA-N
SMILES:
Cc1c[nH]nc1C(=O)O
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.043g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
126.115g/mol
Monoisotopic Mass:
126.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties