2-(1-Methyl-2-propenyl)phenol

Base Information

• Chemical Name: 2-(1-Methyl-2-propenyl)phenol
• CAS No.: 18272-63-4
• Molecular Formula: C10H12O
• Molecular Weight: 148.205
• DSSTox Substance ID: DTXSID501347323
• Nikkaji Number: J414.233K
• Mol file: 18272-63-4.mol

Synonyms:2-(1-Methyl-2-propenyl)phenol;2-(3-Buten-2-yl)phenol;18272-63-4;SCHEMBL10507496;DTXSID501347323

Chemical Property of 2-(1-Methyl-2-propenyl)phenol

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 148.088815002
• Heavy Atom Count: 11
• Complexity: 131

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C=C)C1=CC=CC=C1O

Technology Process of 2-(1-Methyl-2-propenyl)phenol

There total 17 articles about 2-(1-Methyl-2-propenyl)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: 94.0%

(E)-(but-2-en-1-yloxy)benzene (14309-16-1) → 2-(but-3-en-2-yl)phenol (18272-63-4)

Guidance literature:

In N,N-dimethyl-aniline; at 250 ℃; for 1h; Inert atmosphere; Microwave irradiation; Sealed tube;

DOI:10.1002/ejoc.201501151

Reference yield: 56.0%

vinyl magnesium bromide (1826-67-1) + methyllithium (917-54-4) + carbonic acid tert-butyl ester 2-formyl-phenyl ester (346433-42-9) → 2-(but-3-en-2-yl)phenol (18272-63-4)

Guidance literature:

methyllithium; carbonic acid tert-butyl ester 2-formyl-phenyl ester; In diethyl ether; at -78 ℃;

vinyl magnesium bromide; In diethyl ether; at 20 ℃;

DOI:10.1021/jo001752e

Reference yield:

(but-3-en-2-yloxy)benzene (22509-78-0) → 2-(but-3-en-2-yl)phenol (18272-63-4)

Guidance literature:

at 245 - 250 ℃; for 0.166667h;

DOI:10.1021/jm00371a003

upstream raw materials:

diphenylether

(E)-(but-2-en-1-yloxy)benzene

3-methylallyloxy benzene

N,N-diethylaniline

Downstream raw materials:

2-(1-methyl-2-propen-1-yl)-1-methoxybenzene

2,3-Dihydro-3-methylbenzofurane-2-carboxylic acid

(E)-1-(5-azidopent-3-en-2-yl)-2-(phenylethynyl)benzene

1-(3-azidopent-4-en-2-yl)-2-(phenylethynyl)benzene