methyl 4-hydroxy-3-(3-methylbut-2-enyl)benzoate

Base Information

Chemical Name:methyl 4-hydroxy-3-(3-methylbut-2-enyl)benzoate
CAS No.:101511-34-6
Molecular Formula:C13H16 O3
Molecular Weight:220.268
Hs Code.:
DSSTox Substance ID:DTXSID70143973
Nikkaji Number:J579.548F
Wikidata:Q83008045
Metabolomics Workbench ID:136255
ChEMBL ID:CHEMBL463294
Mol file:101511-34-6.mol

Synonyms:Benzoicacid, 4-hydroxy-3-(3-methyl-2-butenyl)-, methyl ester (9CI); Methyl4-hydroxy-3-(3-methyl-2-butenyl)benzoate; Methyl4-hydroxy-3-(3'-methyl-2'-butenyl)benzoate

Suppliers and Price of methyl 4-hydroxy-3-(3-methylbut-2-enyl)benzoate

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 2 raw suppliers

Chemical Property of methyl 4-hydroxy-3-(3-methylbut-2-enyl)benzoate

Chemical Property:

Vapor Pressure:2.75E-05mmHg at 25°C
Boiling Point:347.1°Cat760mmHg
Flash Point:143.9°C
PSA：46.53000
Density:1.093g/cm³
LogP:2.68750
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:220.109944368
Heavy Atom Count:16
Complexity:266

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CCC1=C(C=CC(=C1)C(=O)OC)O)C

Technology Process of methyl 4-hydroxy-3-(3-methylbut-2-enyl)benzoate

There total 8 articles about methyl 4-hydroxy-3-(3-methylbut-2-enyl)benzoate 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: 72.0%

: 4-(1,1-dimethyl-allyloxy)-benzoic acid methyl ester

: 101511-34-6
methyl-4-methoxy-3-(3’-methyl-2’-butenyl)benzoate

Guidance literature:: In N,N-dimethyl-aniline; at 195 ℃; for 1h;
DOI:10.1021/ja002033k

Reference yield: 51.0%

: 5026-62-0
sodium methylparaben

: 870-63-3
prenyl bromide

: 34593-50-5
methyl 4-((3-methylbut-2-en-1-yl)oxy)benzoate

: methyl 3-(3-methylbut-2-en-1-yl)-4-((3-methylbut-2-en-1-yl)oxy)benzoate

: 101511-34-6
methyl-4-methoxy-3-(3’-methyl-2’-butenyl)benzoate

: 99-76-3,156291-94-0
methyl 4-hydroxylbenzoate

Guidance literature:: at 40 ℃; for 24h;
DOI:10.1080/00397911.2017.1288823

Reference yield: 48.0%

: 99-76-3,156291-94-0
methyl 4-hydroxylbenzoate

: 870-63-3
prenyl bromide

: 101511-34-6
methyl-4-methoxy-3-(3’-methyl-2’-butenyl)benzoate

Guidance literature:: methyl 4-hydroxylbenzoate; With sodium carbonate; In water; at 25 ℃; for 2h;

prenyl bromide; In toluene; at 30 ℃; for 20h;
DOI:10.1021/acs.joc.0c02409