Home Carboxys 1,4-Dimethyl-1H-pyrazole-5-carboxylic acid

1,4-Dimethyl-1H-pyrazole-5-carboxylic acid

CAS No.:
13745-58-9
Catalog Number:
AG0013B5
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$232
- +
1g
95%
1 week
United States
$524
- +
Product Description
Catalog Number:
AG0013B5
Chemical Name:
1,4-Dimethyl-1H-pyrazole-5-carboxylic acid
CAS Number:
13745-58-9
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD19228349
IUPAC Name:
2,4-dimethylpyrazole-3-carboxylic acid
InChI:
InChI=1S/C6H8N2O2/c1-4-3-7-8(2)5(4)6(9)10/h3H,1-2H3,(H,9,10)
InChI Key:
FYWSABALQBFSCW-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(C)cnn1C
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.059g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.142g/mol
Monoisotopic Mass:
140.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties