4-[(R)-[(2S,5R)-2,5-Dimethyl-4-Prop-2-Enylpiperazin-1-Yl]-(3-Hydroxyphenyl)Methyl]-N,N-Diethylbenzamide
[CAS# 150428-54-9]

Identification

• Name: 4-[(R)-[(2S,5R)-2,5-Dimethyl-4-Prop-2-Enylpiperazin-1-Yl]-(3-Hydroxyphenyl)Methyl]-N,N-Diethylbenzamide
• Synonyms: 4-[(R)-[(2S,5R)-4-Allyl-2,5-Dimethyl-Piperazin-1-Yl]-(3-Hydroxyphenyl)Methyl]-N,N-Diethyl-Benzamide; 4-[(R)-[(2S,5R)-4-Allyl-2,5-Dimethyl-1-Piperazinyl]-(3-Hydroxyphenyl)Methyl]-N,N-Diethylbenzamide; 4-[(R)-[(2S,5R)-2,5-Dimethyl-4-Prop-2-Enyl-Piperazin-1-Yl]-(3-Hydroxyphenyl)Methyl]-N,N-Diethyl-Benzamide
• Molecular Formula: C₂₇H₃₇N₃O₂
• Molecular Weight: 435.61
• CAS Registry Number: 150428-54-9
• SMILES: [C@H]1(N(C[C@H](N(C1)CC=C)C)[C@@H](C2=CC=CC(=C2)O)C3=CC=C(C=C3)C(=O)N(CC)CC)C
• InChI: 1S/C27H37N3O2/c1-6-16-29-18-21(5)30(19-20(29)4)26(24-10-9-11-25(31)17-24)22-12-14-23(15-13-22)27(32)28(7-2)8-3/h6,9-15,17,20-21,26,31H,1,7-8,16,18-19H2,2-5H3/t20-,21+,26-/m1/s1
• InChIKey: LBLDMHBSVIVJPM-YZIHRLCOSA-N

Properties

• Density: 1.071g/cm³ (Cal.)
• Boiling point: 579.533°C at 760 mmHg (Cal.)
• Flash point: 304.291°C (Cal.)
• solubility: Soluble to 100 mM in 1eq. HCl