3-Benzyloxybenzyl alcohol

Base Information

• Chemical Name: 3-Benzyloxybenzyl alcohol
• CAS No.: 1700-30-7
• Molecular Formula: C14H14O2
• Molecular Weight: 214.264
• Hs Code.: 29062990
• UNII: RMX6S6JFX9
• DSSTox Substance ID: DTXSID70168782
• Nikkaji Number: J150.025B
• Wikidata: Q27451287
• Mol file: 1700-30-7.mol

Synonyms:3-Benzyloxybenzyl alcohol;1700-30-7;(3-(Benzyloxy)phenyl)methanol;3-Benzyloxybenzylalcohol;[3-(Benzyloxy)phenyl]methanol;(3-phenylmethoxyphenyl)methanol;Benzenemethanol, 3-(phenylmethoxy)-;(3-Benzyloxyphenyl)methanol;3-Benzyloxybenzylic Alcohol;MFCD00004642;RMX6S6JFX9;EINECS 216-931-2;3-(Benzyloxy)benzyl alcohol;3-(Phenylmethoxy)benzenemethanol;3-(Phenylmethoxy)-benzenemethanol;4eh8;UNII-RMX6S6JFX9;SCHEMBL80163;3-Benzyloxybenzyl alcohol, 97%;DTXSID70168782;[3-(Benzyloxy)phenyl]methanol #;AB3102;AKOS000247300;CS-W014929;AS-59664;B3857;FT-0615104;A811160;J-010595;Q27451287;0OP

Chemical Property of 3-Benzyloxybenzyl alcohol

Chemical Property:

• Appearance/Colour: white to light yellow crystal powder
• Vapor Pressure: 3.39E-06mmHg at 25°C
• Melting Point: 48 °C(lit.)
• Refractive Index: 1.582
• Boiling Point: 371.5 °C at 760 mmHg
• PKA: 14.30±0.10(Predicted)
• Flash Point: 170.4 °C
• PSA: 29.46000
• Density: 1.14 g/cm³
• LogP: 2.75790
• Solubility.: Chloroform, Dichloromethane, Ethyl Acetate, Methanol
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 214.099379685
• Heavy Atom Count: 16
• Complexity: 187

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-BenzyloxybenzylicAlcohol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/38-36/37/38
• Safety Statements: 37/39-26-36-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=CC=CC(=C2)CO

Technology Process of 3-Benzyloxybenzyl alcohol

There total 23 articles about 3-Benzyloxybenzyl alcohol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 99.0%

3-Benzyloxybenzaldehyde (1700-37-4) → (3-(benzyloxy)phenyl)methanol (1700-30-7)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 0 - 20 ℃; for 2h; Inert atmosphere;

DOI:10.1021/acs.joc.1c00438

Reference yield: 88.9%

methyl 3-(benzyloxy)benzoate (79678-37-8) → (3-(benzyloxy)phenyl)methanol (1700-30-7)

Guidance literature:

With sodium tetrahydroborate; iodine; In tetrahydrofuran; at 70 ℃; for 6h;

DOI:10.1002/ardp.200600146

Reference yield: 85.0%

3-Hydroxybenzyl alcohol (620-24-6) + benzyl chloride (100-44-7) → (3-(benzyloxy)phenyl)methanol (1700-30-7)

Guidance literature:

With N-benzyl-trimethylammonium hydroxide; potassium carbonate; In methanol; N,N-dimethyl-formamide; at 70 ℃; for 18h;

DOI:10.1021/jm00398a019

upstream raw materials:

3-Benzyloxybenzaldehyde

3-Hydroxybenzyl alcohol

benzyl bromide

5-(2-Methoxy-ethoxymethoxymethyl)-benzo[1,3]dioxole

Downstream raw materials:

1-(azidomethyl)-3-(benzyloxy)benzene

3-Benzyloxybenzaldehyde

2-(hydroxymethyl)-6-benzyloxyphenyl boronic acid cyclic monoester

3-(3-benzyloxy-benzyloxy)-benzaldehyde

Refernces

• 1、 Kaicharla, Trinadh,Ngoc, Trung Tran,Teichert, Johannes F.,Tzaras, Dimitrios-Ioannis,Zimmermann, Birte M.. "A Bifunctional Copper Catalyst Enables Ester Reduction with H2: Expanding the Reactivity Space of Nucleophilic Copper Hydrides". . p. 16865 - 16873. Retrieved 2021/10/20.
• 2、 -. "Benzofuran derivatives, preparation method thereof and application of the derivatives in medicine". Paragraph 0713; 0715-0719. . Retrieved 2019/10/01.