Octahydro-9-Hydroxyethyl-1-Methoxy-3,4,4-Trimethyl-1H-3,9alpha-Peroxy-2-Benzoxepin
[CAS# 156382-50-2]

Identification

• Name: Octahydro-9-Hydroxyethyl-1-Methoxy-3,4,4-Trimethyl-1H-3,9alpha-Peroxy-2-Benzoxepin
• Synonyms: Ohmtpb
• Molecular Formula: C₁₆H₂₈O₅
• Molecular Weight: 300.39
• CAS Registry Number: 156382-50-2
• SMILES: [C@H]23C1(OO[C@](O[C@@H]1OC)(C(C2)(C)C)C)[C@@H](CCC3)CCO
• InChI: 1S/C16H28O5/c1-14(2)10-12-7-5-6-11(8-9-17)16(12)13(18-4)19-15(14,3)20-21-16/h11-13,17H,5-10H2,1-4H3/t11-,12+,13-,15-,16?/m0/s1
• InChIKey: BCUBFQJBIVOSFG-QXRAWODBSA-N

Properties

• Density: 1.15g/cm³ (Cal.)
• Boiling point: 375.63°C at 760 mmHg (Cal.)
• Flash point: 180.975°C (Cal.)