Cas no 456-72-4 (Sodium Orotate)
Sodium Orotate structure
Product Name:Sodium Orotate
CAS No:456-72-4
MF:C5H3N2NaO4
MW:178.078091859818
CID:324921
PubChem ID:23683036
Update Time:2025-04-19
Sodium Orotate Chemical and Physical Properties
Names and Identifiers
-
- Sodium Orotate
- A907193
- AKOS037647359
- Orotic acid sodium salt
- ZTHMWDSJKLNDTE-UHFFFAOYSA-M
- Monosodium orolate
- UNII-1K54797G2Z
- NS00079488
- SCHEMBL193604
- sodium;2,4-dioxo-1H-pyrimidine-6-carboxylate
- sodium 2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate
- AS-73418
- OROTIC ACID MONOSODIUM SALT
- OROTATE SODIUM
- J-009152
- 4-PYRIMIDINECARBOXYLIC ACID, 1,2,3,6-TETRAHYDRO-2,6-DIOXO-, MONOSODIUM SALT
- AKOS024319298
- EN300-7830632
- 6-Carboxy-2,4-dihydroxy- pyrimidine
- C5H3N2NaO4
- Orotic acid, monosodium salt
- 6-CARBOXY-2,4-DIHYDROXYPYRIMIDINEMONOSODIUMSALT
- MFCD00050920
- Monosodium orotate
- CCRIS 685
- FT-0687996
- 456-72-4
- SY067132
- 6-Carboxy-2,4-dihydroxypyrimidine monosodium salt
- 4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-, sodium salt, (1:1)
- Q27225416
- Orotic acid, sodium salt
- Sodium 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate
- sodium 2,6-dihydroxypyrimidine-4-carboxylate
- EINECS 205-834-0
- CHEBI:132101
- J-518481
- 1K54797G2Z
- 154-85-8
- 4-PYRIMIDINECARBOXYLIC ACID, 1,2,3,6-TETRAHYDRO-2,6-DIOXO-, SODIUM SALT (1:1)
- DTXSID1021083
-
- Inchi： 1S/C5H4N2O4.Na/c8-3-1-2(4(9)10)6-5(11)7-3;/h1H,(H,9,10)(H2,6,7,8,11);/q;+1/p-1
- InChI Key： ZTHMWDSJKLNDTE-UHFFFAOYSA-M
- SMILES： [Na+].O=C1NC(C=C(C(=O)[O-])N1)=O
Computed Properties
- Exact Mass: 177.99905086g/mol
- Monoisotopic Mass: 177.99905086g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 273
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 98.3?2
Sodium Orotate Related Literature
-
Subrata Kundu,N. Nagapradeep,Balaram Mohapatra,Sourav Biswas,Sandeep Verma,Vadapalli Chandrasekhar CrystEngComm 2016 18 4807
-
3. Complexation between 3-methylorotic (3-methyluracil-6-carboxylic) acid dianion and divalent metal cations. The slow acid dissociation of transition metal complexes and its possible relevance to orotic acid phosphoribosylationDenis Lalart,Jean Guillerez,Guy Dodin,Jacques-Emile Dubois J. Chem. Soc. Perkin Trans. 2 1981 1057
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4. 464. Purines, pyrimidines, and glyoxalines. Part X. Synthesis of uracil-6-phosphonic acid, an analogue of orotic acidM. H. Maguire,R. K. Ralph,G. Shaw J. Chem. Soc. 1958 2299
-
5. Comparison of the acid–base properties of 5- and 6-uracilmethylphosphonate (5Umpa2? and 6Umpa2?) and some related compounds.Evidence for intramolecular hydrogen-bond formation in aqueous solution between (N1)H and the phosphonate group of 6Umpa2?Cristóbal F. Moreno-Luque,Eva Freisinger,Burkhard Costisella,Rolf Griesser,Justyn Ochocki,Bernhard Lippert,Helmut Sigel J. Chem. Soc. Perkin Trans. 2 2001 2005
456-72-4 (Sodium Orotate) Related Products
- 50887-69-9(Orotic acid monohydrate)
- 6153-44-2(Methyl orotate)
- 65-86-1(2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid)
- 24598-73-0(Potassium orotate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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