CAS No.255064-10-9,6-BROMO-4-METHYL-1H-BENZOIMIDAZOLE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	255064-10-9
Name:	6-BROMO-4-METHYL-1H-BENZOIMIDAZOLE
Article Data:	6

Formula:	C₈H₇BrN₂
Molecular Weight:	211.061
Synonyms:	1H-Benzimidazole,6-bromo-4-methyl- (9CI);6-Bromo-4-methyl-1H-benzimidazole;
Density:	1.654 g/cm³
Boiling Point:	420.1 °C at 760 mmHg
Flash Point:	207.9 °C
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	28.68000
LogP:	2.63380

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Specification

The 1H-Benzimidazole,5-bromo-7-methyl- has the CAS registry number 255064-10-9. It belongs to the product category of pharmacetical. This chemical's molecular formula is C₈H₇BrN₂ and molecular weight is 211.06. What's more, its systematic name is 6-bromo-4-methyl-1H-benzimidazole.

Physical properties of 1H-Benzimidazole,5-bromo-7-methyl- are: (1)ACD/LogP: 2.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.45; (4)ACD/LogD (pH 7.4): 2.61; (5)ACD/BCF (pH 5.5): 38.69; (6)ACD/BCF (pH 7.4): 57.02; (7)ACD/KOC (pH 5.5): 425.98; (8)ACD/KOC (pH 7.4): 627.82; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.82 Å²; (13)Index of Refraction: 1.696; (14)Molar Refractivity: 49.13 cm³; (15)Molar Volume: 127.5 cm³; (16)Polarizability: 19.47×10^-24cm³; (17)Surface Tension: 58.6 dyne/cm; (18)Density: 1.654 g/cm³; (19)Flash Point: 207.9 °C; (20)Enthalpy of Vaporization: 64.78 kJ/mol; (21)Boiling Point: 420.1 °C at 760 mmHg; (22)Vapour Pressure: 7.03E-07 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC(=CC2=C1N=CN2)Br
(2)InChI: InChI=1S/C8H7BrN2/c1-5-2-6(9)3-7-8(5)11-4-10-7/h2-4H,1H3,(H,10,11)
(3)InChIKey: WPTOSLNWOXGYRI-UHFFFAOYSA-N