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| CAS No.: | 21302-43-2 |
|---|---|
| Name: | 5-Amino-8-quinolinol dihydrochloride |
| Article Data: | 5 |
| Molecular Structure: | |
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|
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| Formula: | C9H10Cl2N2O |
| Molecular Weight: | 233.097 |
| Synonyms: | 8-Quinolinol,5-amino-, dihydrochloride (7CI,8CI,9CI);5-Amino-8-hydroxyquinolinedihydrochloride;5-Amino-8-quinolinol dihydrochloride; |
| Density: | 1.363g/cm3 |
| Melting Point: | 279 °C (dec.)(lit.) |
| Boiling Point: | 442.6 °C at 760 mmHg |
| Flash Point: | 221.5 °C |
| Solubility: | almost transparency |
| Appearance: | yellow to brown crystalline powder |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-37/39 |
| PSA: | 59.14000 |
| LogP: | 3.70780 |
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Specification
The 5-Amino-8-quinolinol dihydrochloride, with CAS registry number 21302-43-2, belongs to the following product categories: (1)Quinolines, Quinazolines and derivatives; (2)Quinoline & Isoquinoline; (3)Aminoquinolines; (4)Hydroxyquinolines; (5)Quinolines. It has the systematic name of 5-aminoquinolin-8-ol dihydrochloride.
Physical properties of 5-Amino-8-quinolinol dihydrochloride: (1)ACD/LogP: 0.22; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 59.14 Å2; (7)Enthalpy of Vaporization: 72.71 kJ/mol; (8)Vapour Pressure: 1.9E-08 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The 5-Amino-8-quinolinol dihydrochloride irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.Cl.Oc1ccc(N)c2cccnc12
(2)InChI: InChI=1/C9H8N2O.2ClH/c10-7-3-4-8(12)9-6(7)2-1-5-11-9;;/h1-5,12H,10H2;2*1H
(3)InChIKey: VTQDJAUGGZFPOI-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C9H8N2O.2ClH/c10-7-3-4-8(12)9-6(7)2-1-5-11-9;;/h1-5,12H,10H2;2*1H
(5)Std. InChIKey: VTQDJAUGGZFPOI-UHFFFAOYSA-N