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Home Nitros 2-Amino-4,6-dihydroxy-5-nitropyrimidine

2-Amino-4,6-dihydroxy-5-nitropyrimidine

CAS No.:
80466-56-4
Catalog Number:
AG0052YF
Molecular Formula:
C4H4N4O4
Molecular Weight:
172.0990
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%(HPLC)
In Stock USA
United States
$225
- +
5g
95%(HPLC)
In Stock USA
United States
$643
- +
Product Description
Catalog Number:
AG0052YF
Chemical Name:
2-Amino-4,6-dihydroxy-5-nitropyrimidine
CAS Number:
80466-56-4
Molecular Formula:
C4H4N4O4
Molecular Weight:
172.0990
MDL Number:
MFCD00082801
IUPAC Name:
2-amino-4-hydroxy-5-nitro-1H-pyrimidin-6-one
InChI:
InChI=1S/C4H4N4O4/c5-4-6-2(9)1(8(11)12)3(10)7-4/h(H4,5,6,7,9,10)
InChI Key:
ZEBYRLPUWQNZNY-UHFFFAOYSA-N
SMILES:
Oc1nc(N)nc(c1[N+](=O)[O-])O
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.023g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
172.1g/mol
Monoisotopic Mass:
172.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties