Home Other Building Blocks 2,3,6,9-tetrahydro-1H-purine-2,6-dione

2,3,6,9-tetrahydro-1H-purine-2,6-dione

CAS No.:
69-89-6
Catalog Number:
AG0036KL
Molecular Formula:
C5H4N4O2
Molecular Weight:
152.1109
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
96%
In Stock USA
United States
$13
- +
25g
96%
In Stock USA
United States
$25
- +
100g
96%
In Stock USA
United States
$75
- +
500g
96%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG0036KL
Chemical Name:
2,3,6,9-tetrahydro-1H-purine-2,6-dione
CAS Number:
69-89-6
Molecular Formula:
C5H4N4O2
Molecular Weight:
152.1109
MDL Number:
MFCD00078453
IUPAC Name:
3,7-dihydropurine-2,6-dione
InChI:
InChI=1S/C5H4N4O2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)
InChI Key:
LRFVTYWOQMYALW-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(=O)c2c([nH]1)nc[nH]2
EC Number:
200-718-6
UNII:
1AVZ07U9S7
NSC Number:
14664
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.033g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
152.113g/mol
Monoisotopic Mass:
152.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties