6-Methylheptyl Dihydrogen Phosphate
[CAS# 12645-53-3]

Identification

• Name: 6-Methylheptyl Dihydrogen Phosphate
• Synonyms: 6-Methylheptyl dihydrogen phosphate; Isooctanol, dihydrogen phosphate; Isooctyl alcohol, dihydrogen phosphate (8CI)
• Molecular Formula: C₈H₁₉O₄P
• Molecular Weight: 210.21
• CAS Registry Number: 12645-53-3
• EINECS: 235-743-1
• SMILES: O=P(OCCCCCC(C)C)(O)O
• InChI: 1S/C8H19O4P/c1-8(2)6-4-3-5-7-12-13(9,10)11/h8H,3-7H2,1-2H3,(H2,9,10,11)
• InChIKey: RQINQJTUMGQYOB-UHFFFAOYSA-N

Properties

• Density: 1.127g/cm³ (Cal.)
• Boiling point: 321.793°C at 760 mmHg (Cal.)
• Flash point: 148.416°C (Cal.)
• Refractive index: 1.457 (Cal.)