Home Carboxys Methyl 5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate

Methyl 5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate

CAS No.:
6311-73-5
Catalog Number:
AG00ECJP
Molecular Formula:
C6H5N3O6
Molecular Weight:
215.1204
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$333
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Product Description
Catalog Number:
AG00ECJP
Chemical Name:
Methyl 5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate
CAS Number:
6311-73-5
Molecular Formula:
C6H5N3O6
Molecular Weight:
215.1204
MDL Number:
MFCD01346736
IUPAC Name:
methyl 5-nitro-2,4-dioxo-1H-pyrimidine-6-carboxylate
InChI:
InChI=1S/C6H5N3O6/c1-15-5(11)2-3(9(13)14)4(10)8-6(12)7-2/h1H3,(H2,7,8,10,12)
InChI Key:
KPNLMRWITBJHTK-UHFFFAOYSA-N
SMILES:
COC(=O)c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-]
Properties
Complexity:
392  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.018g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.121g/mol
Monoisotopic Mass:
215.018g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties