Quercetin dihydrate

Base Information

• Chemical Name: Quercetin dihydrate
• CAS No.: 6151-25-3
• Molecular Formula: C15H10O7^.2 H2O
• Molecular Weight: 338.29
• Hs Code.: 29329990
• UNII: 53B03V78A6
• DSSTox Substance ID: DTXSID9021219
• Wikidata: Q27261093
• NCI Thesaurus Code: C75768
• Pharos Ligand ID: 5HV9TPVV1DM6
• Metabolomics Workbench ID: 74685
• ChEMBL ID: CHEMBL1520590
• Mol file: 6151-25-3.mol

Synonyms:Quercetin dihydrate;6151-25-3;2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one dihydrate;MFCD00149487;Quercetine dihydrate;CCRIS 3304;Quercetin (dihydrate);3,3',4',5,7-Pentahydroxyflavone dihydrate;DTXSID9021219;UNII-53B03V78A6;Quercetin dihydrate (Sophoretin);2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one;dihydrate;C15H10O7.2H2O;Flavone, 3,3',4',5,7-pentahydroxy-, dihydrate;53B03V78A6;NCGC00017056-01;CAS-6151-25-3;2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one dihydrate;DTXCID401219;Quercetindihydrate;3',4',5,7-tetrahydroxyflavonol;Quercetin,(S);Prestwick_541;SCHEMBL22103;BMK1-G2;CHEMBL1520590;Quercetin dihydrate - Sophoretin;QUERCETIN DIHYDRATE [MI];HMS1569F15;HMS2096F15;HMS3403F09;HMS3656A09;HMS3884N13;BCP07318;HY-N0146;Tox21_110761;Tox21_201150;2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-onedihydrate;HB0543;QUERCETIN DIHYDRATE [WHO-DD];s2347;2-(3,4-dihydroxyphenyl)-3,5,7-;AKOS004910448;Tox21_110761_1;trihydroxy-4H-chromen-4-one dihydrate;C15-H10-O7.2H2-O;CCG-208320;LS-1471;NCGC00015870-27;NCGC00258702-01;AS-13663;SY061661;CS-0007880;FT-0601606;SW148203-5;A833274;Q27261093;F0001-1629;B0005-465575;QUERCETIN DIHYDRATE (SEE ALSOQUERCETIN (117-39-5));4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-, dihydrate;2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one Dihydrate (Quercetin Dihydrate);3,3′,4′,5,7-Pentahydroxyflavone dihydrate

Chemical Property of Quercetin dihydrate

Chemical Property:

• Appearance/Colour: Yellow solid.
• Vapor Pressure: 4.24E-17mmHg at 25°C
• Melting Point: >300 °C(lit.)
• Boiling Point: 642.4 °C at 760 mmHg
• Flash Point: 248.1 °C
• PSA: 149.82000
• Density: 1.680 g/cm3
• LogP: 1.85940
• Storage Temp.: +15C to +30C
• Water Solubility.: practically insoluble
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 1
• Exact Mass: 338.06378202
• Heavy Atom Count: 24
• Complexity: 488

Purity/Quality:

99% ^*data from raw suppliers

Quercetin Dihydrate ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T
• Statements: 25-46-23/24/25
• Safety Statements: 45-53

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O.O.O
• Uses: capillary protectant, antioxidant. antineoplastic, anti-HIV bioflavenoid, antioxidant, antiviral, antimicrobial, enzyme inhibitor Quercetin dihydrate used as a Inhibitor of protein tyrosine kinase, mitochondrial ATPase and phosphodiesterase inhibitor. It Inhibits PI3-kinase activity and slightly inhibits PIP kinase activity.