Inositol-1,2-Cyclic-4,5-Triphosphate
[CAS# 99102-88-2]

Identification

• Name: Inositol-1,2-Cyclic-4,5-Triphosphate
• Synonyms: (2,5,8-Trihydroxy-8-Keto-4-Phosphonooxy-7,9-Dioxa-8$L^{5}-Phosphabicyclo[4.3.0]Nonan-3-Yl) Dihydrogen Phosphate; In-1,2-Ctp; Inositol Cyclic Trisphosphate
• Molecular Formula: C₆H₁₃O₁₄P₃
• Molecular Weight: 402.08
• CAS Registry Number: 99102-88-2
• SMILES: O=[P]1(OC2C(O1)C(O)C(O[P](=O)(O)O)C(O[P](=O)(O)O)C2O)O
• InChI: 1S/C6H13O14P3/c7-1-3(17-21(9,10)11)4(18-22(12,13)14)2(8)6-5(1)19-23(15,16)20-6/h1-8H,(H,15,16)(H2,9,10,11)(H2,12,13,14)
• InChIKey: BRKGTEDJKDFURA-UHFFFAOYSA-N

Properties

• Density: 2.243g/cm³ (Cal.)
• Boiling point: 813.065°C at 760 mmHg (Cal.)
• Flash point: 445.525°C (Cal.)