Astrophylline

Base Information

• Chemical Name: Astrophylline
• CAS No.: 5081-53-8
• Molecular Formula: C19H26N2O
• Molecular Weight: 298.4225
• DSSTox Substance ID: DTXSID201172167
• Nikkaji Number: J1.889.011I
• Mol file: 5081-53-8.mol

Synonyms:(+)-astrophylline;astrophylline;cis-2-(2R,3'S)-(2,3')bipiperidinyl-1'-yl-3-phenylpropenone

Chemical Property of Astrophylline

Chemical Property:

• Boiling Point: 493.2°Cat760mmHg
• Flash Point: 252.1°C
• PSA: 32.34000
• Density: 1.09g/cm³
• LogP: 3.34720
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 298.204513457
• Heavy Atom Count: 22
• Complexity: 387

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCNC(C1)C2CCCN(C2)C(=O)C=CC3=CC=CC=C3
• Isomeric SMILES: C1CCN[C@H](C1)[C@H]2CCCN(C2)C(=O)/C=C\C3=CC=CC=C3