disodium [(2R,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methyl phosphate

• ChemBase ID: 102313
• Molecular Formular: C5H9Na2O8P
• Molecular Mass: 274.073461
• Monoisotopic Mass: 273.98304244
• SMILES: [O-]P(=O)([O-])OC[C@H]1O[C@@H](O)[C@H](O)[C@@H]1O.[Na+].[Na+]
• Canonical SMILES: O[C@H]1[C@H](O)O[C@@H]([C@H]1O)COP(=O)([O-])[O-].[Na+].[Na+]
• InChI: InChI=1S/C5H11O8P.2Na/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7;;/h2-8H,1H2,(H2,9,10,11);;/q;2*+1/p-2/t2-,3-,4-,5-;;/m1../s1
• InChIKey: RHCIGTFSCDIJGH-OROLBPMVSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: disodium [(2R,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methyl phosphate
• IUPAC Traditional name: disodium [(2R,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methyl phosphate
• Synonyms: D-Ribofuranose 5-phosphate disodium salt; D-RIBOSE-5-PHOSPHATE DISODIUM SALT

Database IDs

• CAS Number: 18265-46-8
• EC Number: 242-140-7
• PubChem SID: 162088691
• PubChem CID: 14957827

CALCULATED PROPERTIES

• Acid pKa: 1.2226866
• H Acceptors: 7
• H Donor: 3
• LogD (pH = 5.5): -4.8677535
• LogD (pH = 7.4): -5.958126
• Log P: -2.4257703
• Molar Refractivity: 38.5904 cm^3
• Polarizability: 17.04224 Å^3
• Polar Surface Area: 142.34 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Condition: 0°C, Desiccate, Protect from light

Product Information

• Purity: ≥99%

DETAILS

MP Biomedicals - 02101099

White powder
Disodium salt
Purity: 99+%