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| CAS No.: | 5851-50-3 |
|---|---|
| Name: | 2-NONYLBENZIMIDAZOLE |
| Article Data: | 14 |
| Molecular Structure: | |
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| Formula: | C16H24N2 |
| Molecular Weight: | 244.38 |
| Synonyms: | Benzimidazole,2-nonyl- (7CI,8CI);2-Nonyl-1H-benzimidazole;2-Nonylbenzimidazole;NSC 74053; |
| Density: | 1.003 g/cm3 |
| Melting Point: | 126-128 °C(lit.) |
| Boiling Point: | 416.5 °C at 760 mmHg |
| Flash Point: | 203.2 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 28.68000 |
| LogP: | 4.85600 |
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- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
- Total:14 Page 1 of 1 1
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Specification
The 1H-Benzimidazole,2-nonyl-, with the CAS registry number 5851-50-3, is also known as 2-Nonylbenzimidazole. This chemical's molecular formula is C16H24N2 and molecular weight is 244.38. What's more, its systematic name is 2-nonyl-1H-benzimidazole. It is stable at common pressure and temperature, and it should be sealed and stored in a cool and dry place. What's more, it should be protected from light.
Physical properties of 1H-Benzimidazole,2-nonyl- are: (1)ACD/LogP: 5.83; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.78; (4)ACD/LogD (pH 7.4): 5.77; (5)ACD/BCF (pH 5.5): 1416.09; (6)ACD/BCF (pH 7.4): 13918.34; (7)ACD/KOC (pH 5.5): 3160.9; (8)ACD/KOC (pH 7.4): 31067.53; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 17.82 Å2; (13)Index of Refraction: 1.558; (14)Molar Refractivity: 78.59 cm3; (15)Molar Volume: 243.4 cm3; (16)Polarizability: 31.15×10-24cm3; (17)Surface Tension: 42 dyne/cm; (18)Density: 1.003 g/cm3; (19)Flash Point: 203.2 °C; (20)Enthalpy of Vaporization: 64.37 kJ/mol; (21)Boiling Point: 416.5 °C at 760 mmHg; (22)Vapour Pressure: 9.21E-07 mmHg at 25°C.
Uses of 1H-Benzimidazole,2-nonyl-: it can be used to produce 1-Difluoromethyl-2-nonylbenzimidazole at the temperature of 40 - 50 °C. It will need reagent KOH and solvents H2O, acetone with the reaction time of 3 hours. The yield is about 87%.
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.
You can still convert the following datas into molecular structure:
(1)SMILES: n2c1ccccc1nc2CCCCCCCCC
(2)InChI: InChI=1S/C16H24N2/c1-2-3-4-5-6-7-8-13-16-17-14-11-9-10-12-15(14)18-16/h9-12H,2-8,13H2,1H3,(H,17,18)
(3)InChIKey: YECSLYXTXWSKBO-UHFFFAOYSA-N