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Home Carboxys 5-Methyl-4-nitro-3-isoxazolecarboxylic acid, 10% in THF under Argon

5-Methyl-4-nitro-3-isoxazolecarboxylic acid, 10% in THF under Argon

CAS No.:
960225-75-6
Catalog Number:
AG00IJQU
Molecular Formula:
C5H4N2O5
Molecular Weight:
172.0957
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
10g
95%
In Stock USA
United States
$675
- +
25g
95%
In Stock USA
United States
$1350
- +
Product Description
Catalog Number:
AG00IJQU
Chemical Name:
5-Methyl-4-nitro-3-isoxazolecarboxylic acid, 10% in THF under Argon
CAS Number:
960225-75-6
Molecular Formula:
C5H4N2O5
Molecular Weight:
172.0957
MDL Number:
MFCD11520861
IUPAC Name:
5-methyl-4-nitro-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C5H4N2O5/c1-2-4(7(10)11)3(5(8)9)6-12-2/h1H3,(H,8,9)
InChI Key:
GIRMISJOXYRPLD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)onc1C(=O)O
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.012g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.096g/mol
Monoisotopic Mass:
172.012g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties