1-Phenylhex-5-en-3-ol

Base Information

• Chemical Name: 1-Phenylhex-5-en-3-ol
• CAS No.: 60340-28-5
• Molecular Formula: C12H16O
• Molecular Weight: 176.258
• Hs Code.: 2906299090
• European Community (EC) Number: 870-224-9
• DSSTox Substance ID: DTXSID60435596
• Nikkaji Number: J328.396H
• Mol file: 60340-28-5.mol

Synonyms:1-phenylhex-5-en-3-ol;60340-28-5;1-PHENYL-HEX-5-EN-3-OL;1-phenyl-5-hexen-3-ol;SCHEMBL3239288;DTXSID60435596;AYQFIGASVMPYQZ-UHFFFAOYSA-N;AKOS010644482;SB84409;CS-0238456;EN300-195853

Chemical Property of 1-Phenylhex-5-en-3-ol

Chemical Property:

• Boiling Point: 130 °C(Press: 11 Torr)
• PKA: 14.90±0.20(Predicted)
• PSA: 20.23000
• Density: 0.972±0.06 g/cm3(Predicted)
• LogP: 2.55620
• Storage Temp.: 2-8°C
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 176.120115130
• Heavy Atom Count: 13
• Complexity: 136

Purity/Quality:

99% ^*data from raw suppliers

1-phenylhex-5-en-3-ol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCC(CCC1=CC=CC=C1)O

Technology Process of 1-Phenylhex-5-en-3-ol

There total 187 articles about 1-Phenylhex-5-en-3-ol 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%

3-phenyl-propionaldehyde (104-53-0) + tetraallyl tin (7393-43-3) → 1-phenylhex-5-en-3-ol (60340-28-5)

Guidance literature:

With water; polystyrene supported scandium trifluoromethanesulfonate; at 20 ℃; for 12h;

DOI:10.1002/(SICI)1521-3773(20000204)39:3<567::AID-ANIE567>3.0.CO;2-G

Reference yield: 100.0%

(S)-3-acetoxy-1-phenylhex-5-ene (887195-31-5) → (S)-1-phenyl-5-hexen-3-ol (60340-28-5,98088-54-1,98088-55-2)

Guidance literature:

With ethanol; potassium hydroxide; at 25 ℃; for 3h; Inert atmosphere;

DOI:10.1016/j.tetasy.2012.06.015

Reference yield: 95.0%

3-phenyl-propionaldehyde (104-53-0) + allyl alcohol (107-18-6) → 1-phenylhex-5-en-3-ol (60340-28-5)

Guidance literature:

With indium iodide; triphenylphosphine; bis(acetylacetonate)nickel(II); In various solvent(s); for 1h;

DOI:10.1021/jo049394t

upstream raw materials:

3-phenyl-propionaldehyde

allyl bromide

allyl-trimethyl-silane

allyl iodid

Downstream raw materials:

2-<(methoxycarbonyl)methyl>-4-(2-phenylethyl)-γ-butyrolactone

4-hydroxy-2-methyl-6-phenylhexanoic lactone

Iodo-acetic acid 1-phenethyl-but-3-enyl ester

chloromethyl-dimethyl-(1-phenethyl-but-3-enyloxy)-silane