4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-phenyl-6-(1-piperidinylmethyl)-, (S)-

Base Information

• Chemical Name: 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-phenyl-6-(1-piperidinylmethyl)-, (S)-
• CAS No.: 183051-61-8
• Molecular Formula: C21H23NO4
• Molecular Weight: 353.4116
• DSSTox Substance ID: DTXSID00171380
• Wikidata: Q76279169
• Mol file: 183051-61-8.mol

Synonyms:6-Piperidinomethyl pinocembrin;6-Piperidinomethylpinocembrin;4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-phenyl-6-(1-piperidinylmethyl)-, (S)-;(S)-2,3-Dihydro-5,7-dihydroxy-2-phenyl-6-(1-piperidinylmethyl)-4H-1-benzopyran-4-one;183051-61-8;DTXSID00171380;LS-39553

Chemical Property of 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-phenyl-6-(1-piperidinylmethyl)-, (S)-

Chemical Property:

• Vapor Pressure: 2.76E-14mmHg at 25°C
• Boiling Point: 585°Cat760mmHg
• Flash Point: 307.6°C
• Density: 1.302g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 353.16270821
• Heavy Atom Count: 26
• Complexity: 486

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)CC2=C(C3=C(C=C2O)OC(CC3=O)C4=CC=CC=C4)O
• Isomeric SMILES: C1CCN(CC1)CC2=C(C3=C(C=C2O)O[C@@H](CC3=O)C4=CC=CC=C4)O