1-Methylestra-1,3,5(10),6-Tetrene-3,17beta-Diol
[CAS# 10506-68-0]

Identification

• Name: 1-Methylestra-1,3,5(10),6-Tetrene-3,17beta-Diol
• Synonyms: 1-Methylestra-1,3,5(10),6-Tetraene-3,17Beta-Diol; Estra-1,3,5(10),6-Tetraene-3,17.Beta.-Diol, 1-Methyl-; Nsc9783
• Molecular Formula: C₁₉H₂₄O₂
• Molecular Weight: 284.40
• CAS Registry Number: 10506-68-0
• SMILES: [C@H]1([C@]3(C)[C@@H](CC1)[C@@H]2C=CC4=C([C@H]2CC3)C(=CC(=C4)O)C)O
• InChI: 1S/C19H24O2/c1-11-9-13(20)10-12-3-4-14-15(18(11)12)7-8-19(2)16(14)5-6-17(19)21/h3-4,9-10,14-17,20-21H,5-8H2,1-2H3/t14-,15+,16+,17+,19+/m1/s1
• InChIKey: WCHXTGUTQVBYIP-QSUVVDIXSA-N

Properties

• Density: 1.174g/cm³ (Cal.)
• Boiling point: 467.717°C at 760 mmHg (Cal.)
• Flash point: 219.192°C (Cal.)