Methyl 4-(1,3-dihydroxy-2,2-dimethylpropyl)benzoate
[CAS# 853180-34-4]

Identification

• Name: Methyl 4-(1,3-dihydroxy-2,2-dimethylpropyl)benzoate
• Synonyms: methyl 4-(1,3-dihydroxy-2,2-dimethylpropyl)benzoate
• Molecular Formula: C₁₃H₁₈O₄
• Molecular Weight: 238.28
• CAS Registry Number: 853180-34-4
• SMILES: CC(C)(CO)C(c1ccc(cc1)C(=O)OC)O
• InChI: 1S/C13H18O4/c1-13(2,8-14)11(15)9-4-6-10(7-5-9)12(16)17-3/h4-7,11,14-15H,8H2,1-3H3
• InChIKey: JWLFECIJHGDTPD-UHFFFAOYSA-N

Properties

• Density: 1.16g/cm³ (Cal.)
• Boiling point: 389.989°C at 760 mmHg (Cal.)
• Flash point: 145.258°C (Cal.)
• Refractive index: 1.54 (Cal.)