[2,2-Bis(Hydroxymethyl)Butyl] Hydrogen Adipate
[CAS# 20563-11-5]

Identification

• Name: [2,2-Bis(Hydroxymethyl)Butyl] Hydrogen Adipate
• Synonyms: 6-[2,2-Bis(Hydroxymethyl)Butoxy]-6-Oxo-Hexanoic Acid; 6-(2,2-Dimethylolbutoxy)-6-Keto-Hexanoic Acid; (2,2-Bis(Hydroxymethyl)Butyl) Hydrogen Adipate
• Molecular Formula: C₁₂H₂₂O₆
• Molecular Weight: 262.30
• CAS Registry Number: 20563-11-5
• EINECS: 243-881-9
• SMILES: C(C(=O)OCC(CO)(CC)CO)CCCC(=O)O
• InChI: 1S/C12H22O6/c1-2-12(7-13,8-14)9-18-11(17)6-4-3-5-10(15)16/h13-14H,2-9H2,1H3,(H,15,16)
• InChIKey: VQYGZOOQRFNLFW-UHFFFAOYSA-N

Properties

• Density: 1.193g/cm³ (Cal.)
• Boiling point: 413.297°C at 760 mmHg (Cal.)
• Flash point: 151.228°C (Cal.)