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3,4-Diethoxybenzyl alcohol

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Name

3,4-Diethoxybenzyl alcohol

EINECS N/A
CAS No. 83459-29-4 Density 1.064g/cm3
PSA 38.69000 LogP 1.97630
Solubility N/A Melting Point 39-43 °C(lit.)
Formula C11H16O3 Boiling Point 308.2 °C at 760 mmHg
Molecular Weight 196.246 Flash Point 140.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 83459-29-4 (3,4-Diethoxybenzyl alcohol) Hazard Symbols N/A
Synonyms

Benzylalcohol, 3,4-diethoxy- (4CI);(3,4-Diethoxyphenyl)methanol;3,4-Diethoxybenzylalcohol;

Article Data 9

3,4-Diethoxybenzyl alcohol Specification

The 3,4-Diethoxybenzyl alcohol is an organic compound with the formula C11H16O3. The IUPAC name of this chemical is (3,4-diethoxyphenyl)methanol. With the CAS registry number 83459-29-4, it is also named as benzenemethanol, 3,4-diethoxy-. The product's categories are Benzhydrols, Benzyl & Special Alcohols; Alcohols; C9 to C30; Oxygen Compounds. Besides, it should be stored in a closed, cool, dry place.

Physical properties about 3,4-Diethoxybenzyl alcohol are: (1)ACD/LogP: 1.83; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 6; (5)Polar Surface Area: 27.69 Å2; (6)Index of Refraction: 1.512; (7)Molar Refractivity: 55.32 cm3; (8)Molar Volume: 184.2 cm3; (9)Polarizability: 21.93×10-24cm3; (10)Surface Tension: 36.7 dyne/cm; (11)Density: 1.064 g/cm3; (12)Flash Point: 140.2 °C; (13)Enthalpy of Vaporization: 57.96 kJ/mol; (14)Boiling Point: 308.2 °C at 760 mmHg; (15)Vapour Pressure: 0.000299 mmHg at 25°C.

Preparation: this chemical can be prepared by 3,4-diethoxy-benzoic acid. This reaction will need reagent LiAlH4 and solvent diethyl ether. The yield is about 96%.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cc(ccc1OCC)CO)CC
(2)InChI: InChI=1/C11H16O3/c1-3-13-10-6-5-9(8-12)7-11(10)14-4-2/h5-7,12H,3-4,8H2,1-2H3
(3)InChIKey: ZOLYZUOLHFXYQD-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C11H16O3/c1-3-13-10-6-5-9(8-12)7-11(10)14-4-2/h5-7,12H,3-4,8H2,1-2H3
(5)Std. InChIKey: ZOLYZUOLHFXYQD-UHFFFAOYSA-N

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