1H-Imidazole,2-ethyl-4,5-dihydro-5-methyl- supplier

Name
2-ETHYL-4-METHYL IMIDAZOLIN
EINECS
CAS No. 931-35-1
Article Data9
CAS DataBase
Density 1.03 g/cm³
Solubility
Melting Point
Formula C₆H₁₂N₂
Boiling Point 215.5 °C at 760 mmHg
Molecular Weight 112.175
Flash Point 84.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1H-Imidazole,2-ethyl-4,5-dihydro-4-methyl- (9CI);2-Imidazoline, 2-ethyl-4-methyl-(7CI,8CI);2-Ethyl-4-methyl-2-imidazoline;2-Ethyl-5-methyl-2-imidazoline;
PSA 24.39000
LogP 0.55100

1H-Imidazole,2-ethyl-4,5-dihydro-5-methyl- Specification

The 1H-Imidazole,2-ethyl-4,5-dihydro-5-methyl- is an organic compound with the formula C₆H₁₂N₂. The IUPAC name of this chemical is 2-ethyl-5-methyl-4,5-dihydro-1H-imidazole. With the CAS registry number 931-35-1, it is also named as 2-Ethyl-4,5-dihydro-4-methyl-1H-imidazole. The product's classification codes are TSCA Flag P [A commenced PMN (Premanufacture Notice) substance]; TSCA Flag S [Substance is identified in a proposed or final SNUR (Significant New Use Rule) under TSCA].

Physical properties about 1H-Imidazole,2-ethyl-4,5-dihydro-5-methyl- are: (1)ACD/LogP: 1.54; (2)ACD/LogD (pH 5.5): -0.46; (3)ACD/LogD (pH 7.4): -0.45; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1.65; (7)ACD/KOC (pH 7.4): 1.69; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 15.6 Å²; (12)Index of Refraction: 1.53; (13)Molar Refractivity: 33.38 cm³; (14)Molar Volume: 107.9 cm³; (15)Polarizability: 13.23×10^-24cm³; (16)Surface Tension: 31.5 dyne/cm; (17)Density: 1.03 g/cm³; (18)Flash Point: 84.1 °C; (19)Enthalpy of Vaporization: 43.34 kJ/mol; (20)Boiling Point: 215.5 °C at 760 mmHg; (21)Vapour Pressure: 0.216 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N\1=C(\NC(C)C/1)CC
(2)InChI: InChI=1/C6H12N2/c1-3-6-7-4-5(2)8-6/h5H,3-4H2,1-2H3,(H,7,8)
(3)InChIKey: SHYARJUKNREDGB-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C6H12N2/c1-3-6-7-4-5(2)8-6/h5H,3-4H2,1-2H3,(H,7,8)
(5)Std. InChIKey: SHYARJUKNREDGB-UHFFFAOYSA-N

Product Name

2-ETHYL-4-METHYL IMIDAZOLIN

1H-Imidazole,2-ethyl-4,5-dihydro-5-methyl- Specification

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