Home Carboxys 1-Methyl-1H-pyrazole-3,5-dicarboxylic acid

1-Methyl-1H-pyrazole-3,5-dicarboxylic acid

CAS No.:
75092-39-6
Catalog Number:
AG00G2RA
Molecular Formula:
C6H6N2O4
Molecular Weight:
170.1228
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$93
- +
250mg
95%
In Stock USA
United States
$130
- +
5g
95%
In Stock USA
United States
$2413
- +
Product Description
Catalog Number:
AG00G2RA
Chemical Name:
1-Methyl-1H-pyrazole-3,5-dicarboxylic acid
CAS Number:
75092-39-6
Molecular Formula:
C6H6N2O4
Molecular Weight:
170.1228
MDL Number:
MFCD02090834
IUPAC Name:
1-methylpyrazole-3,5-dicarboxylic acid
InChI:
InChI=1S/C6H6N2O4/c1-8-4(6(11)12)2-3(7-8)5(9)10/h2H,1H3,(H,9,10)(H,11,12)
InChI Key:
MFKWUVYTAQKQMF-UHFFFAOYSA-N
SMILES:
OC(=O)c1nn(c(c1)C(=O)O)C
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
170.124g/mol
Monoisotopic Mass:
170.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties