Structural formula
| Business number | 01FK |
|---|---|
| Molecular formula | C22H26F3N3OS |
| Molecular weight | 437.52 |
| label |
fluphenazine, Hydroxyflupromazine, flupheperazine, guitarmycin |
Numbering system
CAS number:69-23-8
MDL number:None
EINECS number:None
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
1. Character: dark brown viscous oil
2. Density (g/mL, 25/4℃): Uncertain
3. Relative vapor density (g /mL, air=1): Uncertain
4. Melting point (oC): 225~227 (decomposition).
5. Boiling point (oC, normal pressure): Uncertain
6. Boiling point (oC, 5.2kPa): Uncertain
7. Refractive index: Uncertain
8. Flash point (oC): Uncertain
9. Specific rotation (o): Uncertain
10. Autoignition point or ignition Combustion temperature (oC): Uncertain
11. Vapor pressure (kPa, 25oC): Uncertain
12. Saturated vapor pressure (kPa, 60oC): Uncertain
13. Heat of combustion (KJ/mol): Uncertain
14. Critical temperature (oC): Uncertain
15. Critical pressure (KPa): Uncertain
16. The logarithmic value of the oil-water (octanol/water) partition coefficient: Uncertain
17. The upper limit of explosion (%, V/V): Uncertain
18. Lower explosion limit (%, V/V): Uncertain
19. Solubility: Easily soluble in water, slightly soluble in methanol, slightly soluble in ethanol and chloroform, almost insoluble in benzene and Ether. Hygroscopic
Toxicological data
Acute toxicity: Rat intraperitoneal LD50: 100 mg/kg; Rat subcutaneous injection LD50: 640 mg/kg; Mouse oral LD50: 220 mg/kg; Mouse intraperitoneal LD50: 89 mg/kg; Mouse intravenous LD50: 51 mg/kg; Breeding: Rat oral TDLo: 62 mg/kgSEX/DURATION: female 9 day(s) pre-mating female 1-22 day(s) after conception; Rat oral TDLo: 18 mg/kgSEX /DURATION: female 9 day(s) pre-mating;
Ecological data
None
Molecular structure data
1. Molar refractive index: 114.30
2. Molar volume (cm3/mol): 343.8
3. Isotonic specific volume (90.2K ): 885.9
4. Surface tension (dyne/cm): 44.0
5. Polarizability (10-24cm3): 45.31
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 8
4. Number of rotatable chemical bonds: 6
5. Number of tautomers: none
6. Topological molecule polar surface area 55.2
7. Number of heavy atoms: 30
8. Surface charge: 0
9. Complexity: 544
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
None
Storage method
This product should be stored in an airtight container away from light.
Synthesis method
It is produced by alkylation of hydroxyethylpiperazine and bromochloropropane and then condensation with 2-trifluoromethylphenothiazine to form a salt. It can also be obtained by condensation, elimination, cyclization, etc. of m-trifluoromethylaniline.
Purpose
Antipsychotics. It is clinically used for catatonic and paranoid schizophrenia, and is more effective than chlorpromazine for chronic schizophrenia. Preparations include tablets and injections
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