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| Name |
Molindone |
EINECS | N/A |
| CAS No. | 7416-34-4 | Density | 1.14 g/cm3 |
| PSA | 45.33000 | LogP | 1.90070 |
| Solubility | H2O: 19 mg/mL | Melting Point |
180 - 181ºC |
| Formula | C16H24N2O2 | Boiling Point | 462.9 °C at 760 mmHg |
| Molecular Weight | 276.379 | Flash Point | 233.7 °C |
| Transport Information | N/A | Appearance | off-white solid |
| Safety | Risk Codes | 22 | |
| Molecular Structure |
|
Hazard Symbols |
 Xn
|
| Synonyms |
Indol-4(5H)-one,3-ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)- (7CI,8CI);3-Ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)indol-4(5H)-one;Molindone; |
Molindone Chemical Properties
IUPAC Name: 3-ethyl-2-methyl-5-(morpholin-4-ylmethyl)-1,5,6,7-tetrahydroindol-4-one
Empirical Formula: C16H24N2O2
Molecular Weight: 276.374 g/mol
Structure of 4H-Indol-4-one,3-ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)- (CAS NO.7416-34-4):
Index of Refraction: 1.559
Molar Refractivity: 78.28 cm3
Molar Volume: 242.3 cm3
Polarizability: 31.03× 10-24cm3
Surface Tension: 46 dyne/cm
Density: 1.14 g/cm3
Flash Point: 233.7 °C
Enthalpy of Vaporization: 72.4 kJ/mol
Boiling Point: 462.9 °C at 760 mmHg
Vapour Pressure: 9.51E-09 mmHg at 25°C
Classification Code: Antipsychotic agents, Central Nervous System Agents, Central Nervous System Depressants, Drug / Therapeutic Agent, Human Data, Psychotropic Drugs, Tranquilizing Agents
Canonical SMILES: CCC1=C(NC2=C1C(=O)C(CC2)CN3CCOCC3)C
InChI: InChI=1S/C16H24N2O2/c1-3-13-11(2)17-14-5-4-12(16(19)15(13)14)10-18-6-8-20-9-7-18/h12,17H,3-10H2,1-2H3
InChIKey: KLPWJLBORRMFGK-UHFFFAOYSA-N
Molindone Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| human | TDLo | oral | 714ug/kg/D (0.714mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: TREMOR BEHAVIORAL: ANTIPSYCHOTIC | "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969Vol. -, Pg. 402, 1969. |
| man | TDLo | oral | 4285ug/kg/3D- (4.285mg/kg) | BEHAVIORAL: MUSCLE WEAKNESS LUNGS, THORAX, OR RESPIRATION: CYANOSIS KIDNEY, URETER, AND BLADDER: "CHANGES IN TUBULES (INCLUDING ACUTE RENAL FAILURE, ACUTE TUBULAR NECROSIS)" | Journal of Clinical Psychiatry. Vol. 47, Pg. 607, 1986. |
Molindone Safety Profile
Hazard Codes: 
Xn
Risk Statements: 22
R22:Harmful if swallowed.
RIDADR: UN 2811 6.1/PG 3
WGK Germany: 3
RTECS: NM3325000
Hazardous Substances Data: 7416-34-4(Hazardous Substances Data)
Molindone Specification
4H-Indol-4-one,3-ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)- , its cas register number is 7416-34-4. It also can be called (+-)-Molindone ; 3-Ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)-4H-indol-4-one ; 3-Ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)indol-4(5H)-one ; HSDB 3131 ; Indol-4(5H)-one, 3-ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)- ; Molindona ; Molindone ; Molindonum ; UNII-RT3Y3QMF8N . 4H-Indol-4-one,3-ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)- (CAS NO.7416-34-4) is harmful if swallowed.
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