2-Ethylbutyl benzoate

Base Information

Chemical Name:2-Ethylbutyl benzoate
CAS No.:5444-76-8
Molecular Formula:C13H18O2
Molecular Weight:206.285
Hs Code.:
NSC Number:19156
DSSTox Substance ID:DTXSID70969594
Wikidata:Q82952612

Synonyms:2-ethylbutyl benzoate;5444-76-8;NSC19156;SCHEMBL3749140;Benzoic acid, 2-ethylbutyl ester;DTXSID70969594;NSC-19156

Suppliers and Price of 2-Ethylbutyl 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 5 raw suppliers

Chemical Property of 2-Ethylbutyl benzoate

Chemical Property:

Vapor Pressure:0.0043mmHg at 25°C
Boiling Point:278.3°C at 760 mmHg
Flash Point:117.2°C
Density:0.981g/cm³
XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:206.130679813
Heavy Atom Count:15
Complexity:179

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-Ethylbutyl benzoate

There total 3 articles about 2-Ethylbutyl 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:

: 97-95-0
2-ethyl-1-butanol

: 100-51-6,185532-71-2
benzyl alcohol

: 5444-76-8
Benzoesaeure-(2-ethyl-butylester)

: 24318-43-2
4-methoxybenzyl 4-methoxybenzoate

Guidance literature:: With RuH(CO)Cl(PPh₃)(κ²-CP); caesium carbonate; In toluene; for 24h; Schlenk technique; Glovebox; Inert atmosphere; Reflux;
DOI:10.1021/acs.organomet.9b00071

Reference yield:

: 5444-76-8
Benzoesaeure-(2-ethyl-butylester)

Guidance literature:: Benzoylchlorid, 2-Ethyl-butanol, Py.;
DOI:10.1021/jo01350a035

Reference yield:

: 97-95-0
2-ethyl-1-butanol

: 100-51-6,185532-71-2
benzyl alcohol

: 5444-76-8
Benzoesaeure-(2-ethyl-butylester)

Guidance literature:: With C₃₁H₃₂ClN₃PRu⁽²⁺⁾*F₆P^(1-)*Cl^(1-); Cs₂CO₃; In toluene; at 110 ℃; for 48h; Schlenk technique; Inert atmosphere;
DOI:10.1021/acs.joc.1c02828