4-Methylestradiol
[CAS# 6171-48-8]

Identification

• Name: 4-Methylestradiol
• Synonyms: 4-Methylestradiol; Estra-1,3,5(10)-Triene-3,17-Diol, 4-Methyl-, (17Beta)-
• Molecular Formula: C₁₉H₂₆O₂
• Molecular Weight: 286.41
• CAS Registry Number: 6171-48-8
• SMILES: [C@@H]23C1=CC=C(C(=C1CC[C@H]2[C@H]4[C@](CC3)([C@H](CC4)O)C)C)O
• InChI: 1S/C19H26O2/c1-11-12-3-4-15-14(13(12)5-7-17(11)20)9-10-19(2)16(15)6-8-18(19)21/h5,7,14-16,18,20-21H,3-4,6,8-10H2,1-2H3/t14-,15-,16+,18+,19+/m1/s1
• InChIKey: CSHOYPMKTGTOLM-SMYFESCOSA-N

Properties

• Density: 1.151g/cm³ (Cal.)
• Boiling point: 453.335°C at 760 mmHg (Cal.)
• Flash point: 210.35°C (Cal.)