2,3-Dimethoxybenzyl alcohol supplier

Name
2,3-Dimethoxybenzyl alcohol
EINECS 227-099-5
CAS No. 5653-67-8
Article Data36
CAS DataBase
Density 1.111 g/cm³
Solubility
Melting Point 48-51 °C
Formula C₉H₁₂O₃
Boiling Point 257.5 °C at 760 mmHg
Molecular Weight 168.192
Flash Point 113.6 °C
Transport Information
Appearance Off-white powder.
Safety 24/25-36/37-26
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms o-Veratrylalcohol (6CI,7CI,8CI);(2,3-Dimethoxyphenyl)methanol;2,3-Dimethoxybenzenemethanol;2,3-Dimethoxybenzyl alcohol;2,3-Dimethoxybenzylicalcohol;NSC 403220;NSC 87568;
PSA 38.69000
LogP 1.19610

2,3-Dimethoxybenzyl alcohol Specification

The 2,3-Dimethoxybenzyl alcohol, with the CAS registry number 5653-67-8 and EINECS registry number 227-099-5, has the systematic name of (2,3-dimethoxyphenyl)methanol. It is a kind of white to light beige crystalline solid, and belongs to the following product categories: Benzhydrols, Benzyl & Special Alcohols; Alcohols; C9 to C30; Oxygen Compounds. The molecular formula of the chemical is C₉H₁₂O₃.

The characteristics of this chemical are as followings: (1)ACD/LogP: 0.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.77; (4)ACD/LogD (pH 7.4): 0.77; (5)ACD/BCF (pH 5.5): 2.27; (6)ACD/BCF (pH 7.4): 2.27; (7)ACD/KOC (pH 5.5): 62.63; (8)ACD/KOC (pH 7.4): 62.63; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 27.69 Å²; (13)Index of Refraction: 1.521; (14)Molar Refractivity: 46.06 cm³; (15)Molar Volume: 151.2 cm³; (16)Polarizability: 18.26×10^-24cm³; (17)Surface Tension: 37.4 dyne/cm; (18)Density: 1.111 g/cm³; (19)Flash Point: 113.6 °C; (20)Enthalpy of Vaporization: 52.31 kJ/mol; (21)Boiling Point: 257.5 °C at 760 mmHg; (22)Vapour Pressure: 0.00743 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin, and is toxic in contact with skin and if swallowed. Therefore, you had better take the following instructions: Wear suitable protective clothing and gloves, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(c1c(cccc1OC)CO)C
(2)InChI: InChI=1/C9H12O3/c1-11-8-5-3-4-7(6-10)9(8)12-2/h3-5,10H,6H2,1-2H3
(3)InChIKey: CRLBBOBKCLYCJK-UHFFFAOYAK

Product Name

2,3-Dimethoxybenzyl alcohol

2,3-Dimethoxybenzyl alcohol Specification

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