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Home Nitros 2-Methyl-5-nitropyrimidine-4,6-diol

2-Methyl-5-nitropyrimidine-4,6-diol

CAS No.:
53925-27-2
Catalog Number:
AG00DAIO
Molecular Formula:
C5H5N3O4
Molecular Weight:
171.1109
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$104
- +
250mg
95%
In Stock USA
United States
$189
- +
1g
95%
In Stock USA
United States
$378
- +
5g
95%
In Stock USA
United States
$1134
- +
Product Description
Catalog Number:
AG00DAIO
Chemical Name:
2-Methyl-5-nitropyrimidine-4,6-diol
CAS Number:
53925-27-2
Molecular Formula:
C5H5N3O4
Molecular Weight:
171.1109
MDL Number:
MFCD00193996
IUPAC Name:
4-hydroxy-2-methyl-5-nitro-1H-pyrimidin-6-one
InChI:
InChI=1S/C5H5N3O4/c1-2-6-4(9)3(8(11)12)5(10)7-2/h1H3,(H2,6,7,9,10)
InChI Key:
MRYKPLCGITXZRW-UHFFFAOYSA-N
SMILES:
Oc1nc(C)nc(c1[N+](=O)[O-])O
EC Number:
611-066-0
NSC Number:
74447
Properties
Complexity:
311  
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:
0
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties