Inositol 4,5-Bisphosphate
[CAS# 93060-87-8]

Identification

• Name: Inositol 4,5-Bisphosphate
• Synonyms: [(1R,2S,3S,4R,5S,6R)-2,3,4,5-Tetrahydroxy-6-Phosphonooxy-Cyclohexyl] Dihydrogen Phosphate; Myo-Inositol 4,5-Diphosphate; Chebi:18156
• Molecular Formula: C₆H₁₄O₁₂P₂
• Molecular Weight: 340.12
• CAS Registry Number: 93060-87-8
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@H]([C@H]([C@@H]1O)O)O)O[P](=O)(O)O)O[P](=O)(O)O
• InChI: 1S/C6H14O12P2/c7-1-2(8)4(10)6(18-20(14,15)16)5(3(1)9)17-19(11,12)13/h1-10H,(H2,11,12,13)(H2,14,15,16)/t1-,2+,3-,4-,5+,6+/m0/s1
• InChIKey: MCKAJXMRULSUKI-UZAAGFTCSA-N

Properties

• Density: 2.157g/cm³ (Cal.)
• Boiling point: 686.757°C at 760 mmHg (Cal.)
• Flash point: 369.138°C (Cal.)