23,23-Difluoro-25-Hydroxyvitamin D3
[CAS# 95826-03-2]

Identification

• Name: 23,23-Difluoro-25-Hydroxyvitamin D3
• Synonyms: (3Z)-3-[(2Z)-2-[1-(3,3-Difluoro-5-Hydroxy-1,5-Dimethyl-Hexyl)-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylene-Cyclohexan-1-Ol; (3Z)-3-[(2Z)-2-[1-(3,3-Difluoro-5-Hydroxy-1,5-Dimethylhexyl)-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inde
• Molecular Formula: C₂₇H₄₂F₂O₂
• Molecular Weight: 436.62
• CAS Registry Number: 95826-03-2
• SMILES: C(C(C3C1(C(C(/CCC1)=C\C=C\2C(CCC(O)C2)=C)CC3)C)C)C(F)(F)CC(O)(C)C
• InChI: 1S/C27H42F2O2/c1-18-8-11-22(30)15-21(18)10-9-20-7-6-14-26(5)23(12-13-24(20)26)19(2)16-27(28,29)17-25(3,4)31/h9-10,19,22-24,30-31H,1,6-8,11-17H2,2-5H3/b20-9-,21-10-
• InChIKey: QHPKSIWDAYRSIM-UPVMUGGESA-N

Properties

• Density: 1.08g/cm³ (Cal.)
• Boiling point: 547.77°C at 760 mmHg (Cal.)
• Flash point: 285.081°C (Cal.)