(6E,22E)-9,10-Secoergosta-5(10),6,8,22-Tetraen-3-Ol
[CAS# 21307-05-1]

Identification

• Name: (6E,22E)-9,10-Secoergosta-5(10),6,8,22-Tetraen-3-Ol
• Synonyms: Previtamin D2; Tachysterol
• Molecular Formula: C₂₈H₄₄O
• Molecular Weight: 396.65
• CAS Registry Number: 21307-05-1
• SMILES: OC3CC(\C=C\C1=C\CCC2(C)C(C(/C=C/C(C)C(C)C)C)CCC12)=C(\C)CC3
• InChI: 1S/C28H44O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h8-10,12-13,19-20,22,25-27,29H,7,11,14-18H2,1-6H3/b10-9+,13-12+
• InChIKey: XQFJZHAVTPYDIQ-OKLKQMLOSA-N

Properties

• Density: 1.021g/cm³ (Cal.)
• Boiling point: 503.754°C at 760 mmHg (Cal.)
• Flash point: 218.083°C (Cal.)
• Refractive index: 1.583 (Cal.)