Elacestrant
[CAS# 722533-56-4]

Identification

• Name: Elacestrant
• Synonyms: (6R)-6-[2-[ethyl[[4-[2-(ethylamino)ethyl]phenyl]methyl]amino]-4-methoxyphenyl]-5,6,7,8-tetrahydro-2-Naphthalenol
• Molecular Formula: C₃₀H₃₈N₂O₂
• Molecular Weight: 458.63
• CAS Registry Number: 722533-56-4
• EC Number: 861-036-8
• SMILES: N(CC1=CC=C(CCNCC)C=C1)(CC)C2=C(C=CC(OC)=C2)[C@H]3CC=4C(CC3)=CC(O)=CC4

Properties

• Solubility: Insoluble (2.7E^-4 g/L g/L) (25 ºC), Calc.^*
• pKa: 10.36±0.40 (Most acidic 25 ºC), Calc.^*
• Density: 1.111±0.06 g/cm³ (20 ºC 760 Torr), Calc.^*
• Boiling point: 609.5±55.0 ºC (760 Torr), Calc.^*
• Flash point: 322.4±31.5 ºC, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2022 ACD/Labs)