5-Nitrobarbituric acid
Properties
- Molecular formula
- C4H3N3O5
- Molar mass
- 173.08 g/mol
- Exact mass
- 173.0073 Da
- Melting point
- 180.5 °C
- logP
- -0.32Crippen estimate
- Polar surface area
- 125.4 Ų
- H-bond donors / acceptors
- 2 / 3
- 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 the 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
480-68-2SMILES
O=C1N=C(O)C([N+](=O)[O-])C(O)=N1InChIKey
ABICJYZKIYUWEE-UHFFFAOYSA-NInChI
InChI=1S/C4H3N3O5/c8-2-1(7(11)12)3(9)6-4(10)5-2/h1H,(H2,5,6,8,9,10)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-nitro-
- Barbituric acid, 5-nitro-
- Dilituric acid
- 5-Nitro-2,4,6(1H,3H,5H)-pyrimidinetrione
- 5-Nitro-6-hydroxyuracil
- 2,4,6-Trihydroxy-5-nitropyrimidine
- 5-Nitro-2,4,6-pyrimidinetriol
- 5-Nitro-2,4,6-trihydroxypyrimidine
- 6-Hydroxy-5-nitro-2,4(1H,3H)-pyrimidinedione
- NSC 5071
Reactions
Work with 5-Nitrobarbituric acid
Similar compounds
5-Amino-2,4,6(1H,3H,5H)-pyrimidinetrione118-78-547 % similar
Murexide3051-09-037 % similar
1,3-Diethyl 2-nitropropanedioate603-67-832 % similar
Alloxan50-71-532 % similar
Barbituric acid67-52-732 % similar
3-Nitro-2(3H)-pyridinone137280-55-831 % similar
Alloxantin76-24-430 % similar
2-Nitropropane79-46-930 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds