4,6-Dihydroxypyrimidine
Properties
- Molecular formula
- C4H4N2O2
- Molar mass
- 112.09 g/mol
- Exact mass
- 112.0273 Da
- Melting point
- above 230 °C (decomposes)
- logP
- -0.11Crippen estimate
- Polar surface area
- 66.2 Ų
- H-bond donors / acceptors
- 2 / 4
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation52.3% of notifiers
- H319 Causes serious eye irritation52.3% of notifiers
- H335 May cause respiratory irritation51.2% of notifiers
Aggregated from 86 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1193-24-4SMILES
Oc1cc(O)ncn1InChIKey
DUFGYCAXVIUXIP-UHFFFAOYSA-NInChI
InChI=1S/C4H4N2O2/c7-3-1-4(8)6-2-5-3/h1-2H,(H2,5,6,7,8)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 4(3H)-Pyrimidinone, 6-hydroxy-
- 4(1H)-Pyrimidinone, 6-hydroxy-
- 4,6-Pyrimidinediol
- 6-Hydroxy-4(3H)-pyrimidinone
- NSC 22838
- 6-Hydroxypyrimidin-4(3H)-one
- 6-Hydroxy-4-pyrimidinone
Work with 4,6-Dihydroxypyrimidine
Similar compounds
6-Amino-4(3H)-pyrimidinone1193-22-262 % similar
6-Methyl-4(3H)-pyrimidinone3524-87-662 % similar
6-Hydroxypyrimidine-4-carboxylic acid6299-87-250 % similar
4-Hydroxypyrimidine4562-27-045 % similar
4(3H)-Pyrimidinone51953-17-445 % similar
4-Hydroxy-2(1H)-pyridinone626-03-943 % similar
4,6-Difluoropyrimidine2802-62-240 % similar
3(2H)-Isoquinolinone7651-81-240 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.