1H-Imidazole,1-methyl-2-(1-methylethyl)- supplier

Name
1-METHYL-2-ISOPROPYL-IMIDAZOLE
EINECS
CAS No. 22509-02-0
Article Data2
CAS DataBase
Density 0.96 g/cm³
Solubility
Melting Point
Formula C₇H₁₂N₂
Boiling Point 211.9 °C at 760 mmHg
Molecular Weight 124.186
Flash Point 81.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Imidazole,2-isopropyl-1-methyl- (8CI);2-Isopropyl-1-methylimidazole;1-methyl-2-(propan-2-yl)-1H-imidazole;2-Isopropyl-1-methyl-1H-imidazole;
PSA 17.82000
LogP 1.54350

1H-Imidazole,1-methyl-2-(1-methylethyl)- Specification

The 1H-Imidazole,1-methyl-2-(1-methylethyl)-, with the CAS registry number 22509-02-0, is also known as 2-Isopropyl-1-methylimidazole. This chemical's molecular formula is C₇H₁₂N₂ and molecular weight is 124.18. What's more, its systematic name is 1-methyl-2-(propan-2-yl)-1H-imidazole.

Physical properties of 1H-Imidazole,1-methyl-2-(1-methylethyl)- are: (1)ACD/LogP: 0.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.39; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 26.81; (8)#H bond acceptors: 2; (9)#H bond donors: 0; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 17.82 Å²; (12)Index of Refraction: 1.51; (13)Molar Refractivity: 38.7 cm³; (14)Molar Volume: 129.3 cm³; (15)Polarizability: 15.34×10^-24cm³; (16)Surface Tension: 29.3 dyne/cm; (17)Density: 0.96 g/cm³; (18)Flash Point: 81.9 °C; (19)Enthalpy of Vaporization: 42.99 kJ/mol; (20)Boiling Point: 211.9 °C at 760 mmHg; (21)Vapour Pressure: 0.259 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)c1nccn1C
(2)InChI: InChI=1S/C7H12N2/c1-6(2)7-8-4-5-9(7)3/h4-6H,1-3H3
(3)InChIKey: IOILKZYWNMYWJY-UHFFFAOYSA-N

Product Name

1-METHYL-2-ISOPROPYL-IMIDAZOLE

1H-Imidazole,1-methyl-2-(1-methylethyl)- Specification

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