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| CAS No.: | 1123-40-6 |
|---|---|
| Name: | 3,3-DIMETHYLGLUTARIMIDE |
| Article Data: | 15 |
| Molecular Structure: | |
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| Formula: | C7H11NO2 |
| Molecular Weight: | 141.17 |
| Synonyms: | Glutarimide,3,3-dimethyl- (6CI,7CI,8CI);3,3-Dimethylglutarimide;4,4-Dimethyl-2,6-piperidinedione;4,4-Dimethylglutarimide;NSC 58194;NSC99206;b,b-Dimethylglutarimide; |
| EINECS: | 214-373-4 |
| Density: | 1.054 g/cm3 |
| Melting Point: | 144-146 °C(lit.) |
| Boiling Point: | 268 °C at 760 mmHg |
| Flash Point: | 125.3 °C |
| Solubility: | Soluble in water. |
| Appearance: | white to white-grey crystalline powder |
| Hazard Symbols: |
 Xn, Xi
|
| Risk Codes: | 22-36/37/38-43 |
| Safety: | 26-36/37-22 |
| PSA: | 46.17000 |
| LogP: | 0.77800 |
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Specification
The 3,3-Dimethylglutarimide is an organic compound with the formula C7H11NO2. The systematic name of this chemical is 4,4-dimethylpiperidine-2,6-dione. With the CAS registry number 1123-40-6, it is also named as 2,6-piperidinedione, 4,4-dimethyl-. The product's categories are Building Blocks; Heterocyclic Building Blocks; Piperidines. Besides, it is a white to white-grey crystalline powder, which should be stored in a closed cool and dry place.
Physical properties about 3,3-Dimethylglutarimide are: (1)ACD/LogP: 0.99; (2)ACD/LogD (pH 5.5): 0.99; (3)ACD/LogD (pH 7.4): 0.99; (4)ACD/BCF (pH 5.5): 3.35; (5)ACD/BCF (pH 7.4): 3.35; (6)ACD/KOC (pH 5.5): 82.73; (7)ACD/KOC (pH 7.4): 82.73; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)Polar Surface Area: 37.38 Å2; (11)Index of Refraction: 1.45; (12)Molar Refractivity: 35.98 cm3; (13)Molar Volume: 133.8 cm3; (14)Polarizability: 14.26×10-24cm3; (15)Surface Tension: 30.8 dyne/cm; (16)Density: 1.054 g/cm3; (17)Flash Point: 125.3 °C; (18)Enthalpy of Vaporization: 50.6 kJ/mol; (19)Boiling Point: 268 °C at 760 mmHg; (20)Vapour Pressure: 0.0079 mmHg at 25°C.
Uses of 3,3-Dimethylglutarimide: it can be used to produce N-chloro-3,3-dimethylglutarimide at temperature of 0 °C. It will need reagent NaOH, Cl2 and solvent H2O with reaction time of 30 min. The yield is about 85%.
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When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed and may cause sensitisation by skin contact. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing and gloves and do not breathe dust.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC(=O)CC(C)(C)C1
(2)InChI: InChI=1/C7H11NO2/c1-7(2)3-5(9)8-6(10)4-7/h3-4H2,1-2H3,(H,8,9,10)
(3)InChIKey: YUJCWMGBRDBPDL-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C7H11NO2/c1-7(2)3-5(9)8-6(10)4-7/h3-4H2,1-2H3,(H,8,9,10)
(5)Std. InChIKey: YUJCWMGBRDBPDL-UHFFFAOYSA-N
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 152mg/kg (152mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Farmakologiya i Toksikologiya Vol. 27, Pg. 278, 1964. |