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Home Nitros methyl 2-methyl-2-(3-methyl-4-nitro-1H-pyrazol-1-yl)propanoate

methyl 2-methyl-2-(3-methyl-4-nitro-1H-pyrazol-1-yl)propanoate

CAS No.:
1393102-03-8
Catalog Number:
AG019EXH
Molecular Formula:
C9H13N3O4
Molecular Weight:
227.2172
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$200
- +
250mg
95%
In Stock USA
United States
$368
- +
1g
95%
In Stock USA
United States
$735
- +
5g
95%
In Stock USA
United States
$2205
- +
Product Description
Catalog Number:
AG019EXH
Chemical Name:
methyl 2-methyl-2-(3-methyl-4-nitro-1H-pyrazol-1-yl)propanoate
CAS Number:
1393102-03-8
Molecular Formula:
C9H13N3O4
Molecular Weight:
227.2172
MDL Number:
MFCD23162010
IUPAC Name:
methyl 2-methyl-2-(3-methyl-4-nitropyrazol-1-yl)propanoate
InChI:
InChI=1S/C9H13N3O4/c1-6-7(12(14)15)5-11(10-6)9(2,3)8(13)16-4/h5H,1-4H3
InChI Key:
RRNRDMIVNVNMJH-UHFFFAOYSA-N
SMILES:
COC(=O)C(n1nc(c(c1)[N+](=O)[O-])C)(C)C
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.091g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.22g/mol
Monoisotopic Mass:
227.091g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
89.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties