Home Carboxys Methyl 1-methyl-3-nitro-1h-pyrazole-5-carboxylate

Methyl 1-methyl-3-nitro-1h-pyrazole-5-carboxylate

CAS No.:
177409-38-0
Catalog Number:
AG00HZPS
Molecular Formula:
C6H7N3O4
Molecular Weight:
185.1375
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$84
- +
250mg
95%
In Stock USA
United States
$162
- +
Product Description
Catalog Number:
AG00HZPS
Chemical Name:
Methyl 1-methyl-3-nitro-1h-pyrazole-5-carboxylate
CAS Number:
177409-38-0
Molecular Formula:
C6H7N3O4
Molecular Weight:
185.1375
MDL Number:
MFCD18262309
IUPAC Name:
methyl 2-methyl-5-nitropyrazole-3-carboxylate
InChI:
InChI=1S/C6H7N3O4/c1-8-4(6(10)13-2)3-5(7-8)9(11)12/h3H,1-2H3
InChI Key:
YOWXTKMLSGSLMK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(n(n1)C)C(=O)OC
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.044g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.139g/mol
Monoisotopic Mass:
185.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
89.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties