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| CAS No.: | 16265-11-5 | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Name: | 4-Bromo-2-methylimidazole | ||||||||
| Article Data: | 4 | ||||||||
| Molecular Structure: | |||||||||
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| Formula: | C4H5 Br N2 | ||||||||
| Molecular Weight: | 161.001 | ||||||||
| Synonyms: | 1H-Imidazole,4-bromo-2-methyl- (7CI,9CI); Imidazole, 4-bromo-2-methyl- (8CI);4-Bromo-2-methyl-1H-imidazole; 4-Bromo-2-methylimidazole | ||||||||
| Density: | 1.723g/cm3 | ||||||||
| Melting Point: | 158-160°C | ||||||||
| Boiling Point: | 333.9°Cat760mmHg | ||||||||
| Flash Point: | 155.7°C | ||||||||
| Hazard Symbols: |
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| Risk Codes: | 36/37/38 | ||||||||
| Safety: |
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| PSA: | 28.68000 | ||||||||
| LogP: | 1.48060 | ||||||||
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Chemistry
IUPAC Name: 5-Bromo-2-methyl-1H-imidazole
Synonyms of 1H-Imidazole,5-bromo-2-methyl- (CAS NO.16265-11-5): 4-Bromo-2-methylimidazole ; 4-Bromo-2-methyl-1H-imidazole
CAS NO: 16265-11-5
Molecular Formula: C4H5BrN2
Molecular Weight: 161.00
Molecular Structure: 
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 0
Polar Surface Area: 17.82 Å2
Index of Refraction: 1.584
Molar Refractivity: 31.29 cm3
Molar Volume: 93.4 cm3
Surface Tension: 50.5 dyne/cm
Density: 1.723 g/cm3
Flash Point: 155.7 °C
Enthalpy of Vaporization: 55.39 kJ/mol
Boiling Point: 333.9 °C at 760 mmHg
Vapour Pressure: 0.000257 mmHg at 25°C
Melting Point: 158-160°C
Storage temp: Keep Cold
SMILES: Brc1cnc(n1)C
InChI: InChI=1/C4H5BrN2/c1-3-6-2-4(5)7-3/h2H,1H3,(H,6,7)
InChIKey: APLZLUYWLINBOZ-UHFFFAOYAB
Std. InChI: InChI=1S/C4H5BrN2/c1-3-6-2-4(5)7-3/h2H,1H3,(H,6,7)
Std. InChIKey: APLZLUYWLINBOZ-UHFFFAOYSA-N
Product Categories of 1H-Imidazole,5-bromo-2-methyl- (CAS NO.16265-11-5): blocks;Bromides;Imidazoles;Imidazol&Benzimidazole;Imidaxoles
Safety Profile
Hazard Codes :
Xi
Risk Statements: 36/37/38
R36/37/38: 1H-Imidazole,5-bromo-2-methyl- (CAS NO.16265-11-5) is irritating to eyes, respiratory system and skin.
Safety Statements 26-36/37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
Hazard Note: Irritant/Keep Cold