CAS No.191794-20-4,1H-Benzimidazole-2-methanol,4-methyl-(9CI) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	191794-20-4
Name:	1H-Benzimidazole-2-methanol,4-methyl-(9CI)
Article Data:	7

Formula:	C₉H₁₀N₂O
Molecular Weight:	162.191
Synonyms:	1H-Benzimidazole-2-methanol,4-methyl- (9CI);2-(Hydroxymethyl)-4-methylbenzimidazole;(4-Methyl-1H-benzimidazol-2-yl)methanol;(4-Methylbenzimidazol-2-yl)methan-1-ol;
Density:	1.296 g/cm³
Boiling Point:	416.335 °C at 760 mmHg
Flash Point:	205.593 °C
PSA:	48.91000
LogP:	1.36360

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Specification

The 1H-Benzimidazole-2-methanol,7-methyl-, with the CAS registry number 191794-20-4, is also known as (4-Methylbenzimidazol-2-yl)methan-1-ol. It belongs to the product category of Benzimidazole. This chemical's molecular formula is C₉H₁₀N₂O and molecular weight is 162.19. What's more, its systematic name is (4-methyl-1H-benzimidazol-2-yl)methanol.

Physical properties of 1H-Benzimidazole-2-methanol,7-methyl- are: (1)ACD/LogP: 1.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 1 ; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 32; (8)ACD/KOC (pH 7.4): 95; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 48.91 Å²; (13)Index of Refraction: 1.691; (14)Molar Refractivity: 47.896 cm³; (15)Molar Volume: 125.187 cm³; (16)Polarizability: 18.987×10^-24cm³; (17)Surface Tension: 65.431 dyne/cm; (18)Density: 1.296 g/cm³; (19)Flash Point: 205.593 °C; (20)Enthalpy of Vaporization: 70.593 kJ/mol; (21)Boiling Point: 416.335 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cccc2nc(CO)nc12
(2)InChI: InChI=1S/C9H10N2O/c1-6-3-2-4-7-9(6)11-8(5-12)10-7/h2-4,12H,5H2,1H3,(H,10,11)
(3)InChIKey: YEBKEULJXVMWID-UHFFFAOYSA-N