CAS No.83459-29-4,3,4-Diethoxybenzyl alcohol Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	83459-29-4
Name:	3,4-Diethoxybenzyl alcohol
Article Data:	9

Formula:	C₁₁H₁₆O₃
Molecular Weight:	196.246
Synonyms:	Benzylalcohol, 3,4-diethoxy- (4CI);(3,4-Diethoxyphenyl)methanol;3,4-Diethoxybenzylalcohol;
Density:	1.064g/cm³
Melting Point:	39-43 °C(lit.)
Boiling Point:	308.2 °C at 760 mmHg
Flash Point:	140.2 °C
PSA:	38.69000
LogP:	1.97630

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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