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| CAS No.: | 36947-68-9 | |||
|---|---|---|---|---|
| Name: | 2-Isopropylimidazole | |||
| Article Data: | 11 | |||
| Molecular Structure: | ||||
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|
||||
| Formula: | C6H10 N2 | |||
| Molecular Weight: | 110.159 | |||
| Synonyms: | 2-(1-Methylethyl)-1H-imidazole;2-Isopropyl-1H-imidazole; 2-Isopropylimidazole | |||
| EINECS: | 253-286-6 | |||
| Density: | 0.991 g/cm3 | |||
| Melting Point: | 129 - 131 C | |||
| Boiling Point: | 256 - 260 C | |||
| Flash Point: | 114.5 °C | |||
| Solubility: | ||||
| Appearance: | white to yellowish crystals | |||
| Hazard Symbols: |
|
|||
| Risk Codes: | R36/37/38 | |||
| Safety: | S26;S37/39 | |||
| Transport Information: | 25kgs | |||
| PSA: | 28.68000 | |||
| LogP: | 1.53310 | |||
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| Conditions | Yield |
|---|---|
| Stage #1: isobutyraldehyde With ammonia In methanol; water at 25℃; for 1h; Stage #2: Glyoxal With ammonia In methanol; water at 25℃; for 2h; Product distribution / selectivity; | A 2 %Chromat. B 95% |
| With ammonia In water at 25℃; for 1h; Product distribution / selectivity; | A 23 %Chromat. B 56% |
- 40029-86-5
2-(1-Methylethyl)-4,5-dihydro-1H-imidazol
- 36947-68-9
2-isopropylimidazole
| Conditions | Yield |
|---|---|
| nickel In ethanol for 48h; Heating / reflux; | 41% |
- 51294-23-6
2-isopropyl-1H-imidazole-4,5-dicarboxylic acid
A
- 36947-68-9
2-isopropylimidazole
B
- 15719-64-9, 15719-76-3, 97762-63-5
methylammonium carbonate
| Conditions | Yield |
|---|---|
| With ethanol; ammonia | |
| With ammonium hydroxide In ethanol; water at 0 - 20℃; for 96h; | |
| at 0 - 25℃; for 24h; |
- 36947-68-9
2-isopropylimidazole
- 148748-05-4
N-(2,2-Dimethoxy-ethyl)-isobutyramidine
- 36947-68-9
2-isopropylimidazole
| Conditions | Yield |
|---|---|
| Stage #1: N-(2,2-Dimethoxy-ethyl)-isobutyramidine With thioacetamide In methanol at 0 - 45℃; Stage #2: With hydrogenchloride In methanol at 0 - 80℃; |
- 36947-68-9
2-isopropylimidazole
| Conditions | Yield |
|---|---|
| at 50℃; for 1h; | 100% |
- 36947-68-9
2-isopropylimidazole
- 29892-37-3
chloro(dimethylsulfide) gold(I)
A
- 75-18-3
dimethylsulfide
B
- 81196-82-9
(2-isopropylimidazole)2AuCl
| Conditions | Yield |
|---|---|
| In dichloromethane refluxed for 2 h; evapd. to dryness, stirred under Et2O for 24 h, filtered, washed with Et2O; elem. anal.; | A n/a B 100% |
| Conditions | Yield |
|---|---|
| With sodium hydroxide; tetra-(n-butyl)ammonium iodide In toluene for 20h; Heating; | 98% |
- 36947-68-9
2-isopropylimidazole
- 1036396-81-2
4,5-diiodo-2-isopropylimidazole
| Conditions | Yield |
|---|---|
| With iodine; sodium carbonate In 1,4-dioxane; water at 20℃; for 24h; | 97% |
| With iodine; potassium iodide; sodium hydroxide In water at 20℃; Inert atmosphere; | 44% |
| With iodine; sodium carbonate In 1,4-dioxane; water at 20℃; |
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Chemistry
IUPAC Name: 2-Propan-2-yl-1H-imidazole
Following is the structure of 1H-Imidazole,2-(1-methylethyl)- (CAS NO.36947-68-9):
Empirical Formula: C6H10N2
Molecular Weight: 110.157 g/mol
EINECS: 253-286-6
Index of Refraction: 1.505
Molar Refractivity: 32.96 cm3
Molar Volume: 111 cm3
Density: 0.991 g/cm3
Flash Point: 114.5 °C
Melting point: 129-131 °C
Surface Tension: 38.1 dyne/cm
Enthalpy of Vaporization: 47.56 kJ/mol
Boiling Point: 258 °C at 760 mmHg
Vapour Pressure of 1H-Imidazole,2-(1-methylethyl)- (CAS NO.36947-68-9): 0.0227 mmHg at 25 °C
Product Categories of 1H-Imidazole,2-(1-methylethyl)- (CAS NO.36947-68-9): Imidazoles; Building Blocks; Heterocyclic Building Blocks
Canonical SMILES: CC(C)C1=NC=CN1
InChI: InChI=1S/C6H10N2/c1-5(2)6-7-3-4-8-6/h3-5H,1-2H3,(H,7,8)
InChIKey: FUOZJYASZOSONT-UHFFFAOYSA-N
Safety Profile
Hazard Codes: 
Xi
Risk Statements :36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39:Wear suitable gloves and eye/face protection.
WGK Germany: 3
Specification
1H-Imidazole,2-(1-methylethyl)- , its cas register number is 36947-68-9. It also can be called 2-Isopropyl-1H-imidazole ; and 2-Isopropylimidazole .