- InChI
- InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
- InChI Key
- REFJWTPEDVJJIY-UHFFFAOYSA-N
- Formula
- C15H10O7
- SMILES
-
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2c
c(O)cc(O)c12 - Molecular Weight1
- 302.24
- CAS
- 117-39-5
- Other Names
-
- 2,(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one
- 2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one
- 2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one (quercetin)
- 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4(4H)chromenone
- 3,3',4',5,7-Pentahydroxyflavone
- 3,5,7,3',4'-Pentahydroxyflavon
- 3,5,7,3',4'-Pentahydroxyflavone
- 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-
- C.I. 75670
- C.I. Natural Yellow 10
- C.I. Natural red 1
- C.I. Natural yellow 10 & 13
- C.I. natural yellow 13
- Cyanidelonon 1522
- Cyanidenolon 1522
- Flavone, 3,3',4',5,7-pentahydroxy-
- Kvercetin
- Meletin
- NCI-C60106
- NSC 9219
- Quercetine
- Quercetol
- Quercitin
- Quertin
- Quertine
- Ritacetin
- Sophoretin
- T-Gelb bzw. grun 1
- Xanthaurine
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 41.50 | kJ/mol | Solubil... |
| log10WS | -6.78 | Crippen Calculated Property | |
| logPoct/wat | 1.988 | Crippen Calculated Property | |
| McVol | 196.320 | ml/mol | McGowan Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔfusH | 41.50 | kJ/mol | 595.20 | NIST |
Similar Compounds
Find more compounds similar to Quercetin.
Mixtures
- Acetonitrile + Quercetin
- Amylene hydrate + Quercetin
- Acetone + Quercetin
- Acetonitrile + Acetic acid ethenyl ester + Quercetin
- Carbon dioxide + Quercetin
- Water + Quercetin
- Methyl Alcohol + Quercetin
- Ethanol + Quercetin
- Methyl Alcohol + Water + Quercetin
- Ethanol + Water + Quercetin
Sources
- Crippen Method
- Crippen Method
- Solubilities of 7,8-Dihydroxyflavone and 3,3',4',5,7-Pentahydroxyflavone in Supercritical Carbon Dioxide
- Solubility of Flavonoids in Organic Solvents
- Solubility of Quercetin in Water + Methanol and Water + Ethanol from (292.8 to 333.8) K
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.