1-Phenethyl-4-(2-propynyl)-4-piperidinol propionate

Base Information

• Chemical Name: 1-Phenethyl-4-(2-propynyl)-4-piperidinol propionate
• CAS No.: 3733-88-8
• Molecular Formula: C23H29NO6
• Molecular Weight: 415.4795
• Mol file: 3733-88-8.mol

Synonyms:L 2909;1-Phenethyl-4-(2-propynyl)-4-piperidinol propionate;Phenethyl-1 (propyne-2 yl)-4 propionoxy-4 piperidine [French];4-Piperidinol, 1-phenethyl-4-(2-propynyl)-, propionate (ester);Phenethyl-1 (propyne-2 yl)-4 propionoxy-4 piperidine;3733-88-8;LS-117173

Chemical Property of 1-Phenethyl-4-(2-propynyl)-4-piperidinol propionate

Chemical Property:

• Vapor Pressure: 3.53E-06mmHg at 25°C
• Boiling Point: 386.5°C at 760 mmHg
• Flash Point: 119.6°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 415.19948764
• Heavy Atom Count: 30
• Complexity: 514

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)OC1(CCN(CC1)CCC2=CC=CC=C2)CC#C.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CCC(=O)OC1(CCN(CC1)CCC2=CC=CC=C2)CC#C.C(=C/C(=O)O)\C(=O)O