4-Propenyl-2,6-dimethoxyphenol

Base Information

• Chemical Name: 4-Propenyl-2,6-dimethoxyphenol
• CAS No.: 6635-22-9
• Molecular Formula: C11H14 O3
• Molecular Weight: 194.23
• NSC Number: 16952
• UNII: 8178699JLG
• DSSTox Substance ID: DTXSID1075066
• Nikkaji Number: J588.631G,J892.000A
• Wikidata: Q27269222
• Metabolomics Workbench ID: 47716
• Mol file: 6635-22-9.mol

Synonyms:4-Propenyl-2,6-dimethoxyphenol;20675-95-0;Phenol, 2,6-dimethoxy-4-(1E)-1-propenyl-;trans-4-Propenylsyringol;(E)-2,6-Dimethoxy-4-(prop-1-en-1-yl)phenol;2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol;6635-22-9;2,6-Dimethoxy-4-(1-propenyl)phenol;2,6-Dimethoxy-4-propenylphenol;(E)-2,6-dimethoxy-4-propenylphenol;Phenol, 2,6-dimethoxy-4-(1E)-1-propen-1-yl-;2,6-Dimethoxy-4-propenylphenol,(E)-;FEMA No. 3728;trans-2,6-Dimethoxy-4-(1-propenyl)phenol;2,6-dimethoxy-4-[(1E)-prop-1-en-1-yl]phenol;Phenol, 2,6-dimethoxy-4-(1-propenyl)-, (E)-;8178699JLG;2,6-Dimethoxy-4-(E)-1-propenylphenol;Phenol, 2,6-dimethoxy-4-propenyl-, (E)-;4-(1-Propenyl)-2,6-dimethoxyphenol;Phenol, 2,6-dimethoxy-4-(1-propenyl)-;4-propenyl syringol;UNII-8178699JLG;NSC16952;4-(1-Propenyl)syringol;DTXSID1075066;2,6-Dimethoxy-4-propenyl phenol;4-Propenyl-2,6-dimethoxy phenol;CHEBI:173948;YFHOHYAUMDHSBX-SNAWJCMRSA-N;2,6-dimethoxy-4-prop-1-enylphenol;NSC-16952;AKOS005137954;Phenol, 4-(1-propenyl)-2,6-dimethoxy;2,6-Dimethoxy-4-[(E)-1-propenyl]phenol;4-(1-Propenyl)-2,6-dimethoxy(E)-Phenol;Phenol, 2,6-dimethoxy-4-propenyl-, (E);2,6-dimethoxy-4-[(1E)-1-propenyl]phenol;2,6-dimethoxy-4-[(E)-prop-1-enyl]-phenol;4-PROPENYL-2,6-DIMETHOXYPHENOL [FHFI];2,6-DIMETHOXY-4-PROPENYLPHENOL, TRANS-;EN300-2727019;Phenol, 4-(1-propenyl)-2,6-dimethoxy, (E)-;Q27269222

Chemical Property of 4-Propenyl-2,6-dimethoxyphenol

Chemical Property:

• Vapor Pressure: 0.000455mmHg at 25°C
• Boiling Point: 305.4°C at 760 mmHg
• Flash Point: 138.5°C
• PSA: 38.69000
• Density: 1.098g/cm³
• LogP: 2.44250
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 194.094294304
• Heavy Atom Count: 14
• Complexity: 177

Purity/Quality:

99%, ^*data from raw suppliers

4-PROPENYL-2,6-DIMETHOXYPHENOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CC1=CC(=C(C(=C1)OC)O)OC
• Isomeric SMILES: C/C=C/C1=CC(=C(C(=C1)OC)O)OC

Technology Process of 4-Propenyl-2,6-dimethoxyphenol

There total 7 articles about 4-Propenyl-2,6-dimethoxyphenol 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:

lignin (9005-53-2) → 2,6-dimethoxy-4-(prop-1-en-1-yl)-phenol (6635-22-9)

Guidance literature:

With nickel-molybdenum sulfide; hydrogen; In methanol; at 200 ℃; for 6h; under 15001.5 Torr; Pressure; Reagent/catalyst; Temperature; Solvent; Autoclave;

Reference yield:

4-allyl-2,6-dimethoxyphenol (6627-88-9) → 2,6-dimethoxy-4-(prop-1-en-1-yl)-phenol (6635-22-9)

Guidance literature:

With potassium hydroxide; i-Amyl alcohol; at 140 ℃;

Reference yield:

sinapyl 9-acetate → 2,6-dimethoxy-4-(prop-1-en-1-yl)-phenol (6635-22-9)

Guidance literature:

With allylphenol synthase from Larreatri dentata; NADH; In aq. buffer; at 30 ℃; pH=7; Kinetics;

DOI:10.1016/j.abb.2013.10.019

upstream raw materials:

4-allyl-2,6-dimethoxyphenol

aniline

i-Amyl alcohol

Syringenin

Downstream raw materials:

syringic aldehyde

Isovaleriansaeure-<2,6-dimethoxy-4-propenyl-phenylester>

Refernces

• 1、 Kim, Sung-Jin,Vassao, Daniel G.,Moinuddin, Syed G.A.,Bedgar, Diana L.,Davin, Laurence B.,Lewis, Norman G.. "Allyl/propenyl phenol synthases from the creosote bush and engineering production of specialty/commodity chemicals, eugenol/isoeugenol, in Escherichia coli". . p. 37 - 46. Retrieved 2014/01/06.