(3R,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol

• ChemBase ID: 111124
• Molecular Formular: C5H10O5
• Molecular Mass: 150.1299
• Monoisotopic Mass: 150.05282342
• SMILES: OC[C@H]1OC(O)[C@H](O)[C@@H]1O
• Canonical SMILES: OC[C@H]1OC([C@@H]([C@@H]1O)O)O
• InChI: InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3-,4-,5?/m1/s1
• InChIKey: HMFHBZSHGGEWLO-SOOFDHNKSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3R,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol
• IUPAC Traditional name: D-ribofuranose
• Synonyms: D-RIBOSE

Database IDs

• CAS Number: 50-69-1
• PubChem SID: 162097087
• PubChem CID: 5779

CALCULATED PROPERTIES

• Acid pKa: 11.305696
• H Acceptors: 5
• H Donor: 4
• LogD (pH = 5.5): -2.3022048
• LogD (pH = 7.4): -2.3022583
• Log P: -2.3022044
• Molar Refractivity: 29.9609 cm^3
• Polarizability: 12.6405 Å^3
• Polar Surface Area: 90.15 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05217882

MP Biomedicals Rare Chemical collection