2,4,6-Trimethoxybenzyl alcohol supplier

Name
2,4,6-TRIMETHOXYBENZYL ALCOHOL
EINECS
CAS No. 61040-78-6
Article Data18
CAS DataBase
Density 1.131 g/cm³
Solubility
Melting Point 58-61°C
Formula C₁₀H₁₄O₄
Boiling Point 326.2 °C at 760 mmHg
Molecular Weight 198.219
Flash Point 151.1 °C
Transport Information
Appearance
Safety
Risk Codes R36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 2,4,6-Trimethoxybenzenemethanol;2,4,6-Trimethoxybenzyl alcohol;
PSA 47.92000
LogP 1.20470

2,4,6-Trimethoxybenzyl alcohol Specification

The 2,4,6-Trimethoxybenzyl alcohol with cas registry number of 61040-78-6, belongs to the following product categories: Benzhydrols, Benzyl & Special Alcohols. And its systematic name is (2,4,6-trimethoxyphenyl)methanol.

Physical properties about this chemical are: (1)ACD/LogP: 0.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.42; (4)ACD/LogD (pH 7.4): 0.42; (5)ACD/BCF (pH 5.5): 1.23; (6)ACD/BCF (pH 7.4): 1.23; (7)ACD/KOC (pH 5.5): 40.39; (8)ACD/KOC (pH 7.4): 40.39; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 36.92 Å²; (13)Index of Refraction: 1.513; (14)Molar Refractivity: 52.73 cm³; (15)Molar Volume: 175.2 cm³; (16)Polarizability: 20.9×10^-24cm³; (17)Surface Tension: 36.5 dyne/cm; (18)Enthalpy of Vaporization: 60 kJ/mol; (19)Vapour Pressure: 8.92E-05 mmHg at 25°C.

Preparation: this chemical can be prepared by 2,4,6-trimethoxy-benzaldehyde. This reaction will need reagent NaBH4, 1N NaOH and solvent methanol. The reaction time is 2 hour(s) with reaction temperature of 25 ℃. The yield is about 92%.

You can still convert the following datas into molecular structure:
(1)SMILES:O(c1cc(OC)cc(OC)c1CO)C;
(2)InChI:InChI=1/C10H14O4/c1-12-7-4-9(13-2)8(6-11)10(5-7)14-3/h4-5,11H,6H2,1-3H3;
(3)InChIKey:CFXXBVNHYJQNKS-UHFFFAOYAC;
(4)Std. InChI:InChI=1S/C10H14O4/c1-12-7-4-9(13-2)8(6-11)10(5-7)14-3/h4-5,11H,6H2,1-3H3;
(5)Std. InChIKey:CFXXBVNHYJQNKS-UHFFFAOYSA-N.

Product Name

2,4,6-TRIMETHOXYBENZYL ALCOHOL

2,4,6-Trimethoxybenzyl alcohol Specification

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