CAS No.25364-43-6,1-(M-TOLYL)IMIDAZOLE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	25364-43-6
Name:	1-(M-TOLYL)IMIDAZOLE
Article Data:	33

Formula:	C₁₀H₁₀N₂
Molecular Weight:	158.203
Synonyms:	Imidazole,1-m-tolyl- (8CI);1-(3-Methylphenyl)-1H-imidazole;
Density:	1.047 g/cm³
Boiling Point:	301.1 °C at 760 mmHg
Flash Point:	135.9 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	17.82000
LogP:	2.18070

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Specification

This chemical is called 1H-Imidazole, 1-(3-methylphenyl)-, and its systematic name is 1-(3-methylphenyl)-1H-imidazole. With the molecular formula of C₁₀H₁₀N₂, its molecular weight is 158.20. The CAS registry number of this chemical is 25364-43-6. Additionally, its product category is Pharmacetical.

Other characteristics of the 1H-Imidazole, 1-(3-methylphenyl)- can be summarised as followings: (1)ACD/LogP: 2.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.8; (4)ACD/LogD (pH 7.4): 2.42; (5)ACD/BCF (pH 5.5): 9.69; (6)ACD/BCF (pH 7.4): 40.4; (7)ACD/KOC (pH 5.5): 116.51; (8)ACD/KOC (pH 7.4): 485.62; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.82 Å²; (13)Index of Refraction: 1.581; (14)Molar Refractivity: 50.35 cm³; (15)Molar Volume: 151 cm³; (16)Polarizability: 19.96×10^-24cm³; (17)Surface Tension: 38.8 dyne/cm; (18)Density: 1.04 g/cm³; (19)Flash Point: 135.9 °C; (20)Enthalpy of Vaporization: 51.96 kJ/mol; (21)Boiling Point: 301.1 °C at 760 mmHg; (22)Vapour Pressure: 0.00192 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: n2ccn(c1cccc(c1)C)c2
2.InChI: InChI=1/C10H10N2/c1-9-3-2-4-10(7-9)12-6-5-11-8-12/h2-8H,1H3
3.InChIKey: CONMFQGRYDVJRS-UHFFFAOYAA