sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 3-Methyl-4-nitro-1h-pyrazole-5-carboxylic acid

3-Methyl-4-nitro-1h-pyrazole-5-carboxylic acid

CAS No.:
5334-38-3
Catalog Number:
AG00DCZG
Molecular Formula:
C5H5N3O4
Molecular Weight:
171.1109
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$50
- +
1g
97%
In Stock USA
United States
$138
- +
5g
97%
In Stock USA
United States
$438
- +
10g
97%
In Stock USA
United States
$688
- +
Product Description
Catalog Number:
AG00DCZG
Chemical Name:
3-Methyl-4-nitro-1h-pyrazole-5-carboxylic acid
CAS Number:
5334-38-3
Molecular Formula:
C5H5N3O4
Molecular Weight:
171.1109
MDL Number:
MFCD00458002
IUPAC Name:
5-methyl-4-nitro-1H-pyrazole-3-carboxylic acid
InChI:
InChI=1S/C5H5N3O4/c1-2-4(8(11)12)3(5(9)10)7-6-2/h1H3,(H,6,7)(H,9,10)
InChI Key:
RFGSRUNVFVKCGD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)n[nH]c1C(=O)O
NSC Number:
1409
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.028g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
171.112g/mol
Monoisotopic Mass:
171.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties