Alloxantin dihydrate
Properties
- Molecular formula
- C8H10N4O10
- Molar mass
- 322.19 g/mol
- Exact mass
- 322.0397 Da
- logP
- -6.47Crippen estimate
- Polar surface area
- 254.0 Ų
- H-bond donors / acceptors
- 6 / 8
- Rotatable bonds
- 1
Identifiers
CAS number
6011-27-4SMILES
C1(=O)C(C(=O)NC(=O)N1)(C2(C(=O)NC(=O)NC2=O)O)O.O.OInChIKey
BFMIJRCCNVNSBS-UHFFFAOYSA-NInChI
InChI=1S/C8H6N4O8.2H2O/c13-1-7(19,2(14)10-5(17)9-1)8(20)3(15)11-6(18)12-4(8)16;;/h19-20H,(H2,9,10,13,14,17)(H2,11,12,15,16,18);2*1H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- 5-Hydroxy-5-(5-hydroxy-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diazinane-2,4,6-trione;dihydrate
- 5,5'-Bibarbituric acid, 5,5'-dihydroxy-, dihydrate
- (5,5'-Bipyrimidine)-2,2',4,4',6,6'(1H,1'h,3H,3'h,5H,5'h)-hexone, 5,5'-dihydroxy-, dihydrate
- 5,5'-Dihydroxy-(5,5'-bipyrimidine)-2,2',4,4',6,6'(1H,1'h,3H,3'h,5H,5'h)-hexone dihydrate
Work with Alloxantin dihydrate
Similar compounds
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds