2-Phenylethyl heptanoate

Base Information

Chemical Name:2-Phenylethyl heptanoate
CAS No.:5454-11-5
Molecular Formula:C15H22O2
Molecular Weight:234.338
Hs Code.:2915900090
European Community (EC) Number:226-701-3
NSC Number:23063
UNII:8WU2547VZA
DSSTox Substance ID:DTXSID9063904
Nikkaji Number:J155.070E
Wikidata:Q81991084
Mol file:5454-11-5.mol

Synonyms:2-Phenylethyl heptanoate;Phenylethyl heptanoate;5454-11-5;phenethyl heptanoate;Phenylethyl heptylate;Heptanoic acid, 2-phenylethyl ester;Heptanoic acid,2-phenylethyl ester;NSC-23063;Phenylethyl n-heptanoate;2-Phenylethyl heptanoate #;Phenethyl alcohol, heptanoate;Heptanoic acid phenethyl ester;8WU2547VZA;SCHEMBL4353439;DTXSID9063904;NSC23063;EINECS 226-701-3;NSC 23063

Suppliers and Price of 2-Phenylethyl heptanoate

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 10 raw suppliers

Chemical Property of 2-Phenylethyl heptanoate

Chemical Property:

Vapor Pressure:0.000305mmHg at 25°C
Refractive Index:1.492
Boiling Point:321.1 °C at 760 mmHg
Flash Point:114.1 °C
PSA：26.30000
Density:0.971 g/cm³
LogP:3.74270
XLogP3:4.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:9
Exact Mass:234.161979940
Heavy Atom Count:17
Complexity:195

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCC(=O)OCCC1=CC=CC=C1

Technology Process of 2-Phenylethyl heptanoate

There total 3 articles about 2-Phenylethyl heptanoate 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: 81.0%

: 111-14-8
oenanthic acid

: 60-12-8
2-phenylethanol

: 5454-11-5
phenethyl heptanoate

Guidance literature:: With triphenylphosphine; benzyl azide; In neat (no solvent); at 140 ℃; for 0.166667h; Microwave irradiation;
DOI:10.1080/00397911.2016.1211705