4-[3-(1,3-Benzodioxol-5-yl)propyl]phenol

Base Information

Chemical Name:4-[3-(1,3-Benzodioxol-5-yl)propyl]phenol
CAS No.:40135-87-3
Molecular Formula:C16H16O3
Molecular Weight:256.301
Hs Code.:
NSC Number:186296
DSSTox Substance ID:DTXSID20307048
Wikidata:Q82054377
ChEMBL ID:CHEMBL4073910

Synonyms:40135-87-3;4-[3-(1,3-benzodioxol-5-yl)propyl]phenol;NSC186296;CHEMBL4073910;DTXSID20307048;NSC-186296

Suppliers and Price of 4-[3-(1,3-Benzodioxol-5-yl)propyl]phenol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of 4-[3-(1,3-Benzodioxol-5-yl)propyl]phenol

Chemical Property:

Vapor Pressure:3.39E-07mmHg at 25°C
Boiling Point:406.7°Cat760mmHg
Flash Point:199.8°C
Density:1.225g/cm³
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:256.109944368
Heavy Atom Count:19
Complexity:273

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1OC2=C(O1)C=C(C=C2)CCCC3=CC=C(C=C3)O

Technology Process of 4-[3-(1,3-Benzodioxol-5-yl)propyl]phenol

There total 7 articles about 4-[3-(1,3-Benzodioxol-5-yl)propyl]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: 70.0%

: 3-(benzo[d][1,3]dioxol-5-yl)-1-(4-hydroxyphenyl)propan-1-one

: 40135-87-3
4-(3-(benzo[d][1,3]dioxol-5-yl)propyl)phenol

Guidance literature:: With triethylsilane; In trifluoroacetic acid; at 0 - 55 ℃; for 12.5h;
DOI:10.1016/j.bmcl.2017.02.038

Reference yield:

: C₁₆H₁₄O₃

: 40135-87-3
4-(3-(benzo[d][1,3]dioxol-5-yl)propyl)phenol

Guidance literature:: With palladium 10% on activated carbon; hydrogen; In methanol; ethyl acetate; at 20 ℃; for 16h;
DOI:10.1016/j.tetlet.2020.152756

Reference yield:

: 120-57-0,30024-74-9
piperonal

: 40135-87-3
4-(3-(benzo[d][1,3]dioxol-5-yl)propyl)phenol

Guidance literature:: Multi-step reaction with 3 steps

1: potassium hydroxide / methanol / 20 °C

2: palladium 10% on activated carbon; hydrogen / ethyl acetate / 20 °C

3: triethylsilane / trifluoroacetic acid / 12.5 h / 0 - 55 °C

With triethylsilane; palladium 10% on activated carbon; hydrogen; potassium hydroxide; In methanol; ethyl acetate; trifluoroacetic acid; 1: |Aldol Condensation;
DOI:10.1016/j.bmcl.2017.02.038