Acroptilin
[CAS# 41787-75-1]

Identification

• Name: Acroptilin
• Synonyms: [(3Ar,4S,6Ar,8S,9S,9As,9Bs)-8-Hydroxy-3,6-Dimethylene-2-Oxo-Spiro[3A,4,5,6A,7,8,9A,9B-Octahydroazuleno[4,5-B]Furan-9,2'-Oxirane]-4-Yl] (2S)-3-Chloro-2-Hydroxy-2-Methyl-Propanoate; (2S)-3-Chloro-2-Hydroxy-2-Methylpropanoic Acid [(3Ar,4S,6Ar,8S,9S,9As,9Bs)-8-Hydroxy-3,6-Dimethylene-2-Oxo-4-Spiro[3A,4,5,6A,7,8,9A,9B-Octahydroazuleno[4,5-B]Furan-9,2'-Oxirane]Yl] Ester; (2S)-3-Chloro-2-Hydroxy-2-Methyl-Propionic Acid [(3Ar,4S,6Ar,8S,9S,9As,9Bs)-8-Hydroxy-2-Keto-3,6-Dimethylene-Spiro[3A,4,5,6A,7,8,9A,9B-Octahydroazuleno[5,4-D]Furan-9,2'-Oxirane]-4-Yl] Ester
• Molecular Formula: C₁₉H₂₃ClO₇
• Molecular Weight: 398.84
• CAS Registry Number: 41787-75-1
• SMILES: [C@@]12(OC1)[C@H]3[C@@H](C[C@@H]2O)C(C[C@H](OC(=O)[C@](O)(CCl)C)[C@@H]4[C@@H]3OC(=O)C4=C)=C
• InChI: 1S/C19H23ClO7/c1-8-4-11(26-17(23)18(3,24)6-20)13-9(2)16(22)27-15(13)14-10(8)5-12(21)19(14)7-25-19/h10-15,21,24H,1-2,4-7H2,3H3/t10-,11-,12-,13+,14-,15-,18+,19-/m0/s1
• InChIKey: RFRUYYQMUJRBAN-LKUPFZQBSA-N

Properties

• Density: 1.429g/cm³ (Cal.)
• Boiling point: 622.518°C at 760 mmHg (Cal.)
• Flash point: 330.287°C (Cal.)