Serlopitant
[CAS# 860642-69-9]

Identification

• Classification: API
• Name: Serlopitant
• Synonyms: 3-[(3aR,4R,5S,7aS)-5-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]cyclopent-2-en-1-one
• Molecular Formula: C₂₉H₂₈F₇NO₂
• Molecular Weight: 555.53
• CAS Registry Number: 860642-69-9
• SMILES: C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@H]2CC[C@@H]3CN(C[C@H]3[C@@H]2C4=CC=C(C=C4)F)C5=CC(=O)CC5

Properties

• Density: 1.4±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.549, Calc.^*
• Boiling Point: 523.7±50.0 ºC (760 mmHg), Calc.^*
• Flash Point: 270.5±30.1 ºC, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.