CAS No.2302-39-8,4,5-DIMETHYL-1H-IMIDAZOLE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2302-39-8
Name:	4,5-DIMETHYL-1H-IMIDAZOLE
Article Data:	25

Formula:	C₅H₈N₂
Molecular Weight:	96.1319
Synonyms:	Imidazole,4,5-dimethyl- (6CI,7CI,8CI);
EINECS:	218-954-3
Density:	1.028 g/cm³
Melting Point:	121-122 °C
Boiling Point:	284.288 °C at 760 mmHg
Flash Point:	150.982 °C
PSA:	28.68000
LogP:	1.02650

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Specification

The 1H-Imidazole,4,5-dimethyl-, with the CAS registry number 2302-39-8, is also known as 4,5-Dimethylimidazole. It belongs to the product categories of Pharmacetical; Imidazol & Benzimidazole. Its EINECS registry number is 218-954-3. This chemical's molecular formula is C₅H₈N₂ and molecular weight is 96.13. Its IUPAC name is called 4,5-dimethyl-1H-imidazole.

Physical properties of 1H-Imidazole,4,5-dimethyl-: (1)ACD/LogP: 0.76; (2)ACD/LogD (pH 5.5): -1.62; (3)ACD/LogD (pH 7.4): -0.34; (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): 4.96; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Index of Refraction: 1.519; (11)Molar Refractivity: 28.42 cm³; (12)Molar Volume: 93.5 cm³; (13)Surface Tension: 40.7 dyne/cm; (14)Density: 1.027 g/cm³; (15)Flash Point: 151 °C; (16)Enthalpy of Vaporization: 50.23 kJ/mol; (17)Boiling Point: 284.3 °C at 760 mmHg; (18)Vapour Pressure: 0.00515 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(N=CN1)C
(2)InChI: InChI=1S/C5H8N2/c1-4-5(2)7-3-6-4/h3H,1-2H3,(H,6,7)
(3)InChIKey: YSWBFLWKAIRHEI-UHFFFAOYSA-N