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1H-Imidazole,1-(2-chlorophenyl)-

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Name

1H-Imidazole,1-(2-chlorophenyl)-

EINECS N/A
CAS No. 51581-50-1 Density 1.23 g/cm3
PSA 17.82000 LogP 2.52570
Solubility N/A Melting Point N/A
Formula C9H7ClN2 Boiling Point 314.4 °C at 760 mmHg
Molecular Weight 178.621 Flash Point 144 °C
Transport Information N/A Appearance N/A
Safety 24/25 Risk Codes 36
Molecular Structure Molecular Structure of 51581-50-1 (1-(2-CHLOROPHENYL)IMIDAZOLE) Hazard Symbols Xi
Synonyms

1-(2-Chlorophenyl)-1H-imidazole;1-(o-Chlorophenyl)imidazole;

 

1H-Imidazole,1-(2-chlorophenyl)- Specification

The CAS register number of 1H-Imidazole,1-(2-chlorophenyl)- is 51581-50-1. It also can be called as 1-(o-Chlorophenyl)imidazole and the systematic name about this chemical is 1-(2-chlorophenyl)-1H-imidazole. The molecular formula about this chemical is C9H7ClN2 and the molecular weight is 178.62.

Physical properties about 1H-Imidazole,1-(2-chlorophenyl)- are: (1)ACD/LogP: 2.58; (2)ACD/LogD (pH 5.5): 2.41; (3)ACD/LogD (pH 7.4): 2.57; (4)ACD/BCF (pH 5.5): 36.54; (5)ACD/BCF (pH 7.4): 53.03; (6)ACD/KOC (pH 5.5): 410.69; (7)ACD/KOC (pH 7.4): 596.11; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 17.82 Å2; (11)Index of Refraction: 1.613; (12)Molar Refractivity: 50.53 cm3; (13)Molar Volume: 145.1 cm3; (14)Polarizability: 20.03x10-24cm3; (15)Surface Tension: 44.5 dyne/cm; (16)Density: 1.23 g/cm3; (17)Flash Point: 144 °C; (18)Enthalpy of Vaporization: 53.34 kJ/mol; (19)Boiling Point: 314.4 °C at 760 mmHg ; (20)Vapour Pressure: 0.000861 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
When you are using this chemical, avoid contact with skin and eyes. If you want to store it, keep the container tightly closed and sealed in dry and cool places. If you store and use this chemical according the rule, it will not be decomposed. Please ensure that the workshop is well ventilated or equipped with exhaust device.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccccc1n2ccnc2
(2)InChI: InChI=1/C9H7ClN2/c10-8-3-1-2-4-9(8)12-6-5-11-7-12/h1-7H
(3)InChIKey: ZGGZGKAVJNFVHE-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C9H7ClN2/c10-8-3-1-2-4-9(8)12-6-5-11-7-12/h1-7H
(5)Std. InChIKey: ZGGZGKAVJNFVHE-UHFFFAOYSA-N

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