3-Hydroxy-2,2-Bis(Hydroxymethyl)Propyl Heptanoate
[CAS# 21897-55-2]

Identification

• Name: 3-Hydroxy-2,2-Bis(Hydroxymethyl)Propyl Heptanoate
• Synonyms: Heptanoic Acid [3-Hydroxy-2,2-Bis(Hydroxymethyl)Propyl] Ester; Enanthic Acid (3-Hydroxy-2,2-Dimethylol-Propyl) Ester; 3-Hydroxy-2,2-Bis(Hydroxymethyl)Propyl Heptanoate
• Molecular Formula: C₁₂H₂₄O₅
• Molecular Weight: 248.32
• CAS Registry Number: 21897-55-2
• EINECS: 244-642-1
• SMILES: C(C)CCCCC(=O)OCC(CO)(CO)CO
• InChI: 1S/C12H24O5/c1-2-3-4-5-6-11(16)17-10-12(7-13,8-14)9-15/h13-15H,2-10H2,1H3
• InChIKey: PBHMHFVAFKKQIA-UHFFFAOYSA-N

Properties

• Density: 1.115g/cm³ (Cal.)
• Boiling point: 376.321°C at 760 mmHg (Cal.)
• Flash point: 135.008°C (Cal.)