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CAS No.: | 19812-64-7 |
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Name: | 1,14-Tetradecanediol |
Article Data: | 44 |
Molecular Structure: | |
Formula: | C14H30O2 |
Molecular Weight: | 230.391 |
Synonyms: | Tetradecane-1,14-diol; |
EINECS: | 243-341-2 |
Density: | 0.904 g/cm3 |
Melting Point: | 85-90 °C(lit.) |
Boiling Point: | 356.1 °C at 760 mmHg |
Flash Point: | 158.7 °C |
Appearance: | white crystals |
Safety: | 22-24/25 |
PSA: | 40.46000 |
LogP: | 3.65220 |
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The cas register number of 1,14-Tetradecanediol is 19812-64-7. It also can be called as Tetradecane-1,14-diol and the IUPAC Name about this chemical is tetradecane-1,14-diol. When you are using it, please not breathe dust and avoid contact with skin and eyes.
Physical properties about 1,14-Tetradecanediol are: (1)ACD/LogP: 4.18; (2)ACD/LogD (pH 5.5): 4.18; (3)ACD/LogD (pH 7.4): 4.18; (4)ACD/BCF (pH 5.5): 889.43; (5)ACD/BCF (pH 7.4): 889.43; (6)ACD/KOC (pH 5.5): 4493.41; (7)ACD/KOC (pH 7.4): 4493.41; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 15; (11)Polar Surface Area: 18.46Å2; (12)Index of Refraction: 1.461; (13)Molar Refractivity: 69.97 cm3; (14)Molar Volume: 254.6 cm3; (15)Polarizability: 27.74x10-24cm3; (16)Surface Tension: 35.7 dyne/cm; (17)Enthalpy of Vaporization: 69.62 kJ/mol; (18)Boiling Point: 356.1 °C at 760 mmHg; (19)Vapour Pressure: 1.68E-06 mmHg at 25°C.
Preparation: this chemical can be prepared by tetradecanedioic acid at Ambient temperature. This reaction will need reagent LiAlH4 and tetrahydrofuran. The yield is about 91%.
Uses of 1,14-Tetradecanediol: it can be used to produce 14-bromo-tetradecan-1-ol. This reaction will need reagent diethyl ether and hydrogen bromide.
You can still convert the following datas into molecular structure:
(1)SMILES: OCCCCCCCCCCCCCCO
(2)InChI: InChI=1/C14H30O2/c15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16/h15-16H,1-14H2
(3)InChIKey: XLKZJJVNBQCVIX-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C14H30O2/c15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16/h15-16H,1-14H2
(5)Std. InChIKey: XLKZJJVNBQCVIX-UHFFFAOYSA-N