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CAS No.: | 3208-26-2 |
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Name: | 9-PHENYL-1-NONANOL |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C15H24O |
Molecular Weight: | 220.355 |
Synonyms: | 1-Nonanol,9-phenyl- (7CI,8CI);9-Phenyl-1-nonanol;9-Phenylnonanol; |
Density: | 0.936 g/cm3 |
Boiling Point: | 328.4 °C at 760 mmHg |
Flash Point: | 123.8 °C |
Safety: | 24/25 |
PSA: | 20.23000 |
LogP: | 3.95210 |
This chemical is called Benzenenonanol, and its systematic name is 9-phenylnonan-1-ol. With the molecular formula of C15H24O, its molecular weight is 220.35. The CAS registry number of this chemical is 3208-26-2. Avoid contacting with skin and eys if you use it. In addition, keep this chemcial in the cool and dry place.
Other characteristics of the Benzenenonanol can be summarised as followings: (1)ACD/LogP: 4.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.92; (4)ACD/LogD (pH 7.4): 4.92; (5)ACD/BCF (pH 5.5): 3249.8; (6)ACD/BCF (pH 7.4): 3249.8; (7)ACD/KOC (pH 5.5): 11360.08; (8)ACD/KOC (pH 7.4): 11360.08; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.504; (14)Molar Refractivity: 69.76 cm3; (15)Molar Volume: 235.3 cm3; (16)Polarizability: 27.65×10-24cm3; (17)Surface Tension: 36.6 dyne/cm; (18)Density: 0.936 g/cm3; (19)Flash Point: 123.8 °C; (20)Enthalpy of Vaporization: 60.25 kJ/mol; (21)Boiling Point: 328.4 °C at 760 mmHg; (22)Vapour Pressure: 7.68E-05 mmHg at 25°C.
Production method of this chemical: The Benzenenonanol could be obtained by the reactant of Benzenenonanol. This reaction needs the reagent of lithium aluminium hydride, and the solvent of diethyl ether. The yield is 84 %.
Uses of this chemical: The Benzenenonanol could react with toluene-4-sulfonyl chloride, and obtain the toluene-4-sulfonic acid 9-phenyl-nonyl ester. This reaction needs the reagent of pyridine. The yield is 95 %. In addition, this reaction should be taken for 3 hours.
You can still convert the following datas into molecular structure:
1.SMILES: OCCCCCCCCCc1ccccc1
2.InChI: InChI=1/C15H24O/c16-14-10-5-3-1-2-4-7-11-15-12-8-6-9-13-15/h6,8-9,12-13,16H,1-5,7,10-11,14H2
3.InChIKey: AAOYEEWVNUXGDK-UHFFFAOYAH