6-Dimethylaminomethyl pinocembrin

Base Information

• Chemical Name: 6-Dimethylaminomethyl pinocembrin
• CAS No.: 183051-62-9
• Molecular Formula: C18H19 N O4
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID60171381
• Wikidata: Q76279172
• Mol file: 183051-62-9.mol

Synonyms:6-Dimethylaminomethyl pinocembrin;183051-62-9;(S)-2,3-Dihydro-5,7-dihydroxy-6-((dimethylamino)methyl)-2-phenyl-4H-1-benzopyran-4-one;4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-6-((dimethylamino)methyl)-2-phenyl-, (S)-;(2S)-6-(DIMETHYLAMINOMETHYL)-5,7-DIHYDROXY-2-PHENYL-CHROMAN-4-ONE;(2S)-6-[(dimethylamino)methyl]-5,7-dihydroxy-2-phenyl-2,3-dihydrochromen-4-one;DTXSID60171381;LS-39549;(S)-6-((Dimethylamino)methyl)-5,7-dihydroxy-2-phenylchroman-4-one;(2S)-6-[(dimethylamino)methyl]-5,7-dihydroxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one

Chemical Property of 6-Dimethylaminomethyl pinocembrin

Chemical Property:

• Vapor Pressure: 4.26E-12mmHg at 25°C
• Boiling Point: 535.9°Cat760mmHg
• Flash Point: 277.9°C
• PSA: 70.00000
• Density: 1.297g/cm³
• LogP: 2.86590
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 313.13140809
• Heavy Atom Count: 23
• Complexity: 421

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC1=C(C2=C(C=C1O)OC(CC2=O)C3=CC=CC=C3)O
• Isomeric SMILES: CN(C)CC1=C(C2=C(C=C1O)O[C@@H](CC2=O)C3=CC=CC=C3)O