(Z)-Hex-3-enyl benzoate

Base Information

Chemical Name:(Z)-Hex-3-enyl benzoate
CAS No.:72200-74-9
Molecular Formula:C13H16O2
Molecular Weight:204.269
Hs Code.:
DSSTox Substance ID:DTXSID8047555
Wikidata:Q81976451
Mol file:72200-74-9.mol

Synonyms:3-Hexen-1-ol, benzoate, (3Z)-;(Z) - hex - 3 - enyl benzoate;3-hexen-1-ol, 1-benzoato, (3z)-;hex-3-en-1-yl benzoate;benzoic acid hex-3-enyl ester;DTXSID8047555;FT-0623854;D88740

Suppliers and Price of (Z)-Hex-3-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 7 raw suppliers

Chemical Property of (Z)-Hex-3-enyl benzoate

Chemical Property:

Vapor Pressure:0.00203mmHg at 25°C
Refractive Index:1.513
Boiling Point:290.8 °C at 760 mmHg
Flash Point:124.6 °C
PSA：26.30000
Density:1.003 g/cm³
LogP:3.19970
XLogP3:4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:204.115029749
Heavy Atom Count:15
Complexity:203

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC=CCCOC(=O)C1=CC=CC=C1

Technology Process of (Z)-Hex-3-enyl benzoate

There total 5 articles about (Z)-Hex-3-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: 90.0%

: 307976-47-2
benzoic acid hex-3-ynyl ester

: 72200-74-9
benzoic acid 3-hexenyl ester

Guidance literature:: With hydrogen; triethylamine; [2-iodo-4-(3-trifluoromethyl-3H-diazirin-3-yl)phenyl]methanol; palladium on activated charcoal; In methanol; at 20 ℃; for 0.166667h; under 760.051 Torr;
DOI:10.1021/jo0012243

Reference yield:

: 1002-28-4
3-hexyn-1-ol

: 72200-74-9
benzoic acid 3-hexenyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 60 percent / pyridine / 1 h / 20 °C

2: 90 percent / H₂; Et₃N; [2-I-4-(3-CF₃-3H-diazirin-3-yl)phenyl]methanol / Pd/C / methanol / 0.17 h / 20 °C / 760.05 Torr

With pyridine; hydrogen; triethylamine; [2-iodo-4-(3-trifluoromethyl-3H-diazirin-3-yl)phenyl]methanol; palladium on activated charcoal; In methanol; 1: Substitution / 2: Catalytic hydrogenation;
DOI:10.1021/jo0012243

Reference yield:

: 98-88-4
benzoyl chloride

: 72200-74-9
benzoic acid 3-hexenyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 60 percent / pyridine / 1 h / 20 °C

2: 90 percent / H₂; Et₃N; [2-I-4-(3-CF₃-3H-diazirin-3-yl)phenyl]methanol / Pd/C / methanol / 0.17 h / 20 °C / 760.05 Torr

With pyridine; hydrogen; triethylamine; [2-iodo-4-(3-trifluoromethyl-3H-diazirin-3-yl)phenyl]methanol; palladium on activated charcoal; In methanol; 1: Substitution / 2: Catalytic hydrogenation;
DOI:10.1021/jo0012243