The CAS registry number of Benzenemethanamine, 2-(1H-imidazol-1-yl)- is 25373-55-1. It belongs to the product category of Benzene series. This chemical's molecular formula is C10H11N3 and molecular weight is 173.21444. What's more, its systematic name is 1-[2-(1H-Imidazol-1-yl)phenyl]methanamine.
Physical properties about Benzenemethanamine, 2-(1H-imidazol-1-yl)- is 25373-55-1 are: (1)ACD/LogP: 0.85; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.36; (4)ACD/LogD (pH 7.4): -0.66; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 2.14; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 21.06 Å2; (13)Index of Refraction: 1.622; (14)Molar Refractivity: 52.45 cm3; (15)Molar Volume: 148.7 cm3; (16)Polarizability: 20.79×10-24cm3; (17)Surface Tension: 48.1 dyne/cm; (18)Density: 1.16 g/cm3; (19)Flash Point: 171 °C; (20)Enthalpy of Vaporization: 60.48 kJ/mol; (21)Boiling Point: 359.2 °C at 760 mmHg; (22)Vapour Pressure: 2.42E-05 mmHg at 25 °C.
When you are dealing with this chemical, you should be very careful. It is harmful if it is swallowed. It may cause burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer). And in case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1) SMILES: n2ccn(c1c(cccc1)CN)c2
(2) InChI: InChI=1/C10H11N3/c11-7-9-3-1-2-4-10(9)13-6-5-12-8-13/h1-6,8H,7,11H2
(3) InChIKey: JHDMBRSDCFLSTD-UHFFFAOYAB
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