7-Hydroxycholest-4-En-3-One
[CAS# 25876-54-4]

Identification

• Name: 7-Hydroxycholest-4-En-3-One
• Synonyms: 4-Cholesten-6β-ol-3-one; 7-Hydroxycholest-4-en-3-one; 7-Hydroxycholest-4-en-3-one #
• Molecular Formula: C₂₇H₄₄O₂
• Molecular Weight: 400.64
• CAS Registry Number: 25876-54-4
• SMILES: O=C4/C=C3/CC(O)C2C1CCC(C1(C)CCC2C3(C)CC4)C(C)CCCC(C)C
• InChI: 1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h15,17-18,21-25,29H,6-14,16H2,1-5H3
• InChIKey: IOIZWEJGGCZDOL-UHFFFAOYSA-N

Properties

• Density: 1.032g/cm³ (Cal.)
• Boiling point: 516.685°C at 760 mmHg (Cal.)
• Flash point: 218.477°C (Cal.)
• Refractive index: 1.531 (Cal.)