19-Hydroxy-10(S),19-Dihydrovitamin D3
[CAS# 62077-06-9]

Identification

• Name: 19-Hydroxy-10(S),19-Dihydrovitamin D3
• Synonyms: (1R,3Z,4R)-3-[(2E)-2-[(1R,3As,7Ar)-1-[(1R)-1,5-Dimethylhexyl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-(Hydroxymethyl)Cyclohexan-1-Ol; (1R,3Z,4R)-3-[(2E)-2-[(1R,3As,7Ar)-1-[(1R)-1,5-Dimethylhexyl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-(Hydroxymethyl)-1-Cyclohexanol; (1R,3Z,4R)-3-[(2E)-2-[(1R,3As,7Ar)-1-[(1R)-1,5-Dimethylhexyl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylol-Cyclohexan-1-Ol
• Molecular Formula: C₂₇H₄₆O₂
• Molecular Weight: 402.66
• CAS Registry Number: 62077-06-9
• SMILES: [C@]13([C@H](\C(CCC1)=C\C=C2/[C@@H](CC[C@@H](O)C2)CO)CC[C@@H]3[C@@H](CCCC(C)C)C)C
• InChI: 1S/C27H46O2/c1-19(2)7-5-8-20(3)25-14-15-26-21(9-6-16-27(25,26)4)10-11-22-17-24(29)13-12-23(22)18-28/h10-11,19-20,23-26,28-29H,5-9,12-18H2,1-4H3/b21-10+,22-11-/t20-,23+,24-,25-,26+,27-/m1/s1
• InChIKey: AJXHPHZACZICEG-AXNHMIKBSA-N

Properties

• Density: 1.045g/cm³ (Cal.)
• Boiling point: 530.48°C at 760 mmHg (Cal.)
• Flash point: 221.052°C (Cal.)