5-Nitro-2,4(1H,3H)-pyrimidinedione
Properties
- Molecular formula
- C4H3N3O4
- Molar mass
- 157.08 g/mol
- Exact mass
- 157.0124 Da
- Melting point
- 280–285 °C
- logP
- -0.20Crippen estimate
- Polar surface area
- 109.4 Ų
- H-bond donors / acceptors
- 2 / 6
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 31 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
611-08-5SMILES
O=[N+]([O-])c1cnc(O)nc1OInChIKey
TUARVSWVPPVUGS-UHFFFAOYSA-NInChI
InChI=1S/C4H3N3O4/c8-3-2(7(10)11)1-5-4(9)6-3/h1H,(H2,5,6,8,9)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- 2,4(1H,3H)-Pyrimidinedione, 5-nitro-
- Uracil, 5-nitro-
- 5-Nitrouracil
- 5-Nitro-2,4-dihydroxypyrimidine
- NSC 9790
- 5-Nitropyrimidine-2,4-diol
- 5-Nitropyrimidine-2,4(1H,3H)-dione
- 1,2,3,6-Tetrahydro-5-nitro-2,6-dioxopyrimidine
Work with 5-Nitro-2,4(1H,3H)-pyrimidinedione
Similar compounds
3,5-Dinitro-2(1H)-pyridinone2980-33-851 % similar
5-Fluoro-3-nitro-2(1H)-pyridinone136888-20-550 % similar
5-Bromo-3-nitro-2-pyridone15862-34-749 % similar
3-Nitro-2(1H)-pyridinone6332-56-549 % similar
6-Methyl-5-nitro-2,4(1H,3H)-pyrimidinedione16632-21-646 % similar
Pyrimidine-2,4,5-triol20636-41-345 % similar
3-Nitro-5-(trifluoromethyl)-2(1H)-pyridinone33252-64-145 % similar
4-Methyl-5-nitro-2(1H)-pyridinone21901-41-745 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds