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CAS No.: | 4706-81-4 |
---|---|
Name: | 2-Tetradecanol |
Article Data: | 13 |
Molecular Structure: | |
Formula: | C14H30O |
Molecular Weight: | 214.392 |
Synonyms: | Tetradecanol-2;1-Methyltridecyl alcohol;NSC 87599; |
EINECS: | 225-192-5 |
Density: | 0.832 g/cm3 |
Melting Point: | 35-36 °C(lit.) |
Boiling Point: | 284 °C at 760 mmHg |
Flash Point: | 106 °C |
Appearance: | WHITE POWDER |
Safety: | 22-24/25 |
PSA: | 20.23000 |
LogP: | 4.67820 |
This chemical is called 2-Tetradecanol, and its systematic name is Tetradecan-2-ol. With the molecular formula of C14H30O, its molecular weight is 214.39. The CAS registry number of the chemical is 4706-81-4. Additionally, its product categories are Alcohols; C9 to C30; Oxygen Compounds. However, this chemical should be sealed in the dry and ventilated place under the normal temperature, away from light.
Other characteristics of 2-Tetradecanol can be summarised as followings: (1)ACD/LogP: 6.01; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6; (4)ACD/LogD (pH 7.4): 6; (5)ACD/BCF (pH 5.5): 21558.2; (6)ACD/BCF (pH 7.4): 21558.2; (7)ACD/KOC (pH 5.5): 44013.48; (8)ACD/KOC (pH 7.4): 44013.48; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.443; (14)Molar Refractivity: 68.4 cm3; (15)Molar Volume: 257.5 cm3; (16)Polarizability: 27.11×10-24cm3; (17)Surface Tension: 30.1 dyne/cm; (18)Density: 0.832 g/cm3; (19)Flash Point: 106 °C; (20)Enthalpy of Vaporization: 60.69 kJ/mol; (21)Boiling Point: 284 °C at 760 mmHg; (22)Vapour Pressure: 0.000354 mmHg at 25°C.
Production method of this chemical: The 2-Tetradecanol could be obtained by the reactant of 2-Methoxymethoxy-tetradecane. This reaction needs the reagents of Dowex-50W-X2, aq. MeOH. The yield is 94 %. In addition, this reaction should be taken for 8 hours at heated condition.
Uses of this chemical: The 2-Tetradecanol could react with Phenyl tellurocyanate, and obtain the 2-Phenyltellanyl-tetradecane. This reaction needs the reagent of Tributylphosphine, and the solvent of CH2Cl2. The yield is 45 %. In addition, this reaction should be taken for 30 minutes at the ambient temperature.
When you are using this chemical, please be cautious about it as the following: Do not breathe dust when you use this chemical. Avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
1.SMILES: OC(CCCCCCCCCCCC)C
2.InChI: InChI=1/C14H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14-15H,3-13H2,1-2H3
3.InChIKey: BRGJIIMZXMWMCC-UHFFFAOYAK
4.Std. InChI: InChI=1S/C14H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14-15H,3-13H2,1-2H3
5.Std. InChIKey: BRGJIIMZXMWMCC-UHFFFAOYSA-N