2-(Prop-1-en-1-yl)phenol

Base Information

• Chemical Name: 2-(Prop-1-en-1-yl)phenol
• CAS No.: 6380-21-8
• Molecular Formula: C9H10 O
• Molecular Weight: 134.178
• Hs Code.: 2907199090
• European Community (EC) Number: 228-961-3
• UNII: 3P9OH16T17
• Nikkaji Number: J206.986E,J784.373I
• Mol file: 6380-21-8.mol

Synonyms:2-Propenylphenol;2-(prop-1-en-1-yl)phenol;6380-21-8;(E)-o-Propenylphenol;Phenol, o-propenyl-, (E)-;23619-59-2;2-(1-Propenyl)phenol, (E)-;Phenol, 2-(1E)-1-propenyl-;3P9OH16T17;Phenol, 2-(1-propenyl)-, (E)-;Phenol, 2-(1E)-1-propen-1-yl-;2-[(E)-prop-1-enyl]phenol;2-propenyl-phenol;2-Propenylphenol,c&t;2-((E)-1-Propenyl)phenol;UNII-3P9OH16T17;E-2-hydroxy-beta-methylstyrene;SCHEMBL1038004;SCHEMBL1876846;(E)-o-Hydroxy-beta-methylstyrene;MFCD00002248;STK397282;2-[(1E)-prop-1-en-1-yl]phenol;AKOS008968634;E-2-HYDROXY-.BETA.-METHYLSTYRENE;(E)-O-HYDROXY-.BETA.-METHYLSTYRENE;EN300-18425

Chemical Property of 2-(Prop-1-en-1-yl)phenol

Chemical Property:

• Vapor Pressure: 0.0416mmHg at 25°C
• Melting Point: -6°C
• Refractive Index: n20/D 1.578(lit.)
• Boiling Point: 230-231 °C(lit.)
• Flash Point: 195 °F
• PSA: 20.23000
• Density: 1.044 g/mL at 25 °C(lit.)
• LogP: 2.42530
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 134.073164938
• Heavy Atom Count: 10
• Complexity: 118

Purity/Quality:

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

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Phenols
• Canonical SMILES: CC=CC1=CC=CC=C1O
• Isomeric SMILES: C/C=C/C1=CC=CC=C1O

Technology Process of 2-(Prop-1-en-1-yl)phenol

There total 40 articles about 2-(Prop-1-en-1-yl)phenol 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: 100.0%

o-Allylphenol (1745-81-9) → 2-(prop-1-enyl)phenol (6380-21-8)

Guidance literature:

tris(triphenylphosphine)ruthenium(II) chloride; at 100 ℃; for 1h;

DOI:10.1055/s-2004-825597

Reference yield: 95.0%

o-(2-propenyl)phenyl trifluoromethanesulfonate (109586-43-8) → 2-(prop-1-enyl)phenol (6380-21-8)

Guidance literature:

With N¹,N¹,N¹²,N¹²-tetramethyl-7,8-dihydro-6H-dipyrido[1,2-a:2,1'-c][1,4]diazepine-2,12-diamine; In N,N-dimethyl-formamide; at 20 ℃; for 2h; Inert atmosphere;

DOI:10.1039/c2ob25116g

Reference yield: 60.0%

ethyltriphenylphosphonium bromide (1530-32-1) + salicylaldehyde (90-02-8) → 2-(prop-1-enyl)phenol (6380-21-8)

Guidance literature:

With 1,8-diazabicyclo[5.4.0]undec-7-ene; In acetonitrile; for 12h; Reflux;

DOI:10.1002/adsc.201600082

upstream raw materials:

ethylmagnesium iodide

salicylaldehyde

o-Allylphenol

allyl phenyl ether

Downstream raw materials:

2-((2-(4-nitrophenyl)hydrazono)methyl)phenol

3-(2-propenyl-phenoxy)-propane-1,2-diol

2,2'-methylenedioxybis(phenyl-1-propene)

salicylaldehyde

Refernces

• 1、 Gregg, Zackary R.,Glickert, Elise,Xu, Ruoshui,Diver, Steven T.. "Ruthenium Removal Using Silica-Supported Aromatic Isocyanides". supporting information. . Retrieved 2021/05/13.
• 2、 Koizumi, Yu,Jin, Xiongjie,Yatabe, Takafumi,Miyazaki, Ray,Hasegawa, Jun-ya,Nozaki, Kyoko,Mizuno, Noritaka,Yamaguchi, Kazuya. "Selective Synthesis of Primary Anilines from NH3 and Cyclohexanones by Utilizing Preferential Adsorption of Styrene on the Pd Nanoparticle Surface". supporting information. p. 10893 - 10897. Retrieved 2019/07/12.