- Dimefline
- Dimefline hydrochloride
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Cas Database |
| Name |
Dimefline |
EINECS | 214-616-4 |
| CAS No. | 1165-48-6 | Density | 1.163g/cm3 |
| PSA | 42.68000 | LogP | 3.83860 |
| Solubility | N/A | Melting Point |
109.5°C |
| Formula | C20H21 N O3 | Boiling Point | 465.3°Cat760mmHg |
| Molecular Weight | 323.392 | Flash Point | 235.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by ingestion, intraperitoneal, intravenous, rectal, and subcutaneous routes. When heated to decomposition it emits very toxic fumes of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Flavone,8-[(dimethylamino)methyl]-7-methoxy-3-methyl- (6CI,7CI,8CI); 2-Phenyl-3-methyl-7-methoxy-8-dimethylaminomethylchromone;3-Methyl-7-methoxy-8-[(dimethylamino)methyl]flavone;8-(Dimethylaminomethyl)-7-methoxy-3-methylflavone; Dimeflin; Dimefline; NSC169869; Remeflin |
Article Data | 2 |
Dimefline Chemical Properties
Molecule structure of Dimefline (CAS NO.1165-48-6) :
IUPAC Name: 8-(dimethylaminomethyl)-7-methoxy-3-methyl-2-phenylchromen-4-one
Molecular Weight: 323.38564 g/mol
Molecular Formula: C20H21NO3
Density: 1.163 g/cm3
Boiling Point: 465.3 °C at 760 mmHg
Flash Point: 235.2 °C
Index of Refraction: 1.587
Molar Refractivity: 93.49 cm3
Molar Volume: 277.8 cm3
Polarizability: 37.06×10-24 cm3
Surface Tension: 43.9 dyne/cm
Enthalpy of Vaporization: 72.68 kJ/mol
Vapour Pressure: 7.81E-09 mmHg at 25 °C
XLogP3: 3.6
H-Bond Acceptor: 4
Rotatable Bond Count: 4
Exact Mass: 323.152144
MonoIsotopic Mass: 323.152144
Topological Polar Surface Area: 38.8
Heavy Atom Count: 24
Complexity: 493
Canonical SMILES: CC1=C(OC2=C(C1=O)C=CC(=C2CN(C)C)OC)C3=CC=CC=C3
InChI: InChI=1S/C20H21NO3/c1-13-18(22)15-10-11-17(23-4)16(12-21(2)3)20(15)24-19(13)14-8-6-5-7-9-14/h5-11H,12H2,1-4H3
InChIKey: ZXFQRFXLFWWKLX-UHFFFAOYSA-N
EINECS: 214-616-4
Dimefline Uses
Dimefline (CAS NO.1165-48-6) is used as central nervous system stimulant drug.
Dimefline Production
Dimefline is made of resorcinol by condensation, cyclization, methylation, chlorine methylation, amination and into a salt.
Dimefline Toxicity Data With Reference
| 1. | orl-rat LD50:40 mg/kg | RPOBAR Research Progress in Organic Biological and Medicinal Chemistry. 1 (1964),423. | ||
| 2. | ipr-rat LD50:6 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 18 (1971),185. | ||
| 3. | ivn-rat LD50:1800 µg/kg | RPOBAR Research Progress in Organic Biological and Medicinal Chemistry. 1 (1964),423. | ||
| 4. | rec-rat LD50:10 mg/kg | RPOBAR Research Progress in Organic Biological and Medicinal Chemistry. 1 (1964),423. | ||
| 5. | orl-mus LD50:12 mg/kg | |||
| 6. |
| RPOBAR Research Progress in Organic Biological and Medicinal Chemistry. 1 (1964),423. | ||
| 7. | ipr-mus LD50:4800 µg/kg | JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. 3 (1961),471. | ||
| 8. | scu-mus LD50:4 mg/kg | RPOBAR Research Progress in Organic Biological and Medicinal Chemistry. 1 (1964),423. | ||
| 9. | ivn-dog LDLo:1 mg/kg | RPOBAR Research Progress in Organic Biological and Medicinal Chemistry. 1 (1964),423. |
Dimefline Safety Profile
Poison by ingestion, intraperitoneal, intravenous, rectal, and subcutaneous routes. When heated to decomposition it emits very toxic fumes of NOx.
Dimefline Specification
Dimefline (CAS NO.1165-48-6) is white crystalline powder. It is soluble in water and slightly soluble in ethanol. Dimefline (CAS NO.1165-48-6) is also called 4H-1-Benzopyran-4-one, 8-((dimethylamino)methyl)-7-methoxy-3-methyl-2-phenyl- ; 5-18-12-00083 (Beilstein Handbook Reference) ; 8-((Dimethylamino)methyl)-7-methoxy-3-methyl-2-phenyl-4H-1-benzopyran-4-one ; 8-((Dimethylamino)methyl)-7-methoxy-3-methyl-2-phenylflavone ; 8-(Dimethylaminomethyl)-7-methoxy-3-methylflavone ; 8-Dimethylaminomethyl-7-methoxy-3-methyl-2-phenylchromone ; BRN 1395114 ; Dimeflin ; Dimeflina ; Dimeflina [INN-Spanish] ; Dimeflinum ; Dimeflinum [INN-Latin] ; Dimelfin ; HSDB 2110 ; Malivan ; N-(7-Methoxy-3-methyl-4-oxo-2-phenyl-4H-chromen-8-yl)methyl-N,N-dimethylamine ; NSC 169869 ; Reanimil ; Remeflin (VAN) ; UNII-9WII5M0DU3 .
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