Isodomedin
[CAS# 39388-61-9]

Identification

• Name: Isodomedin
• Synonyms: Isodomedin
• Molecular Formula: C₂₂H₃₂O₆
• Molecular Weight: 392.49
• CAS Registry Number: 39388-61-9
• SMILES: [C@@]124C(C(=C)[C@@H]([C@H]1O)CC[C@H]2[C@@]3([C@H](C[C@@H](C([C@H]3C[C@H]4O)(C)C)OC(=O)C)O)C)=O
• InChI: 1S/C22H32O6/c1-10-12-6-7-13-21(5)14(8-16(25)22(13,18(10)26)19(12)27)20(3,4)17(9-15(21)24)28-11(2)23/h12-17,19,24-25,27H,1,6-9H2,2-5H3/t12-,13-,14+,15-,16+,17-,19+,21-,22-/m0/s1
• InChIKey: DHKJGTMHEVCMKJ-NWWLGSBGSA-N

Properties

• Density: 1.277g/cm³ (Cal.)
• Boiling point: 550.757°C at 760 mmHg (Cal.)
• Flash point: 187.862°C (Cal.)