Structural formula
| Business number | 03PH |
|---|---|
| Molecular formula | C18H16N2O6S |
| Molecular weight | 388.39 |
| label |
8-Hydroxyquinoline hemisulfate salt, disinfectant, preservative, Deodorant |
Numbering system
CAS number:134-31-6
MDL number:MFCD00013095
EINECS number:205-137-1
RTECS number:VC8260000
BRN number:3760550
PubChem number:24895760
Physical property data
None
Toxicological data
Acute toxicity data :
Rat Sutra MouthLD50：1200mg/kg
Rat skin LD50：>4mg/kg
Mouse Sutra Mouth LD50: 280mg/kg
Mouse pathway Unknown LDLo: 50mg/kg
Guinea pig oral LDLo：1200mg/kg
Mutation data ：
Bacterial Typhimurium Salmonella: 20ug/plate
Bacterial Typhimurium Salmonella DNA repair: 250ug/disc
Human leukocytes: 10umol/L
Human lymphocytes ：13umol/L
Human lymphocytes Sister chromatid changes: 10umol/L
Ecological data
None
Molecular structure data
None
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP):
2. Number of hydrogen bond donors: 4
3. Number of hydrogen bond acceptors: 6
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: 5
6. Topological molecular polar surface area (TPSA):149
7. Number of heavy atoms: 27
8. Surface charge: 0
9. Complexity: 200
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. The number of uncertain atomic stereocenters: 0
13. Determine the number of stereocenters of chemical bonds: 0
14. Uncertain number of chemical bond stereocenters: 0
TPSA): 149
7. Number of heavy atoms: 27
8. Surface charge: 0
9. Complexity: 200
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. The number of uncertain atomic stereocenters: 0
13. Determine the number of stereocenters of chemical bonds: 0
14. Uncertain number of chemical bond stereocenters: 0
15. Number of covalent bond units: 3
Properties and stability
basic properties
Light yellow crystalline powder. Slightly saffron smell. Burning smell. Dissolved in 100 parts of glycerin. Easily soluble in water, slightly soluble in ethanol, insoluble in ether. Melting point 175~178℃.
Storage method
storage
Seal and store away from light.
Synthesis method
None
Purpose
Purpose
Disinfectants. preservative. Deodorant
gin-bottom-alt: auto” align=left>15. Number of covalent bond units ：3
Properties and stability
basic properties
Light yellow crystalline powder. Slightly saffron smell. Burning smell. Dissolved in 100 parts of glycerin. Easily soluble in water, slightly soluble in ethanol, insoluble in ether. Melting point 175~178℃.
Storage method
storage
Seal and store away from light.
Synthesis method
None
Purpose
Purpose
Disinfectants. preservative. Deodorant
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