2-Pentyl butyrate

Base Information

Chemical Name:2-Pentyl butyrate
CAS No.:60415-61-4
Molecular Formula:C9H18O2
Molecular Weight:158.241
Hs Code.:
UNII:O5709B244U
DSSTox Substance ID:DTXSID50866810
Nikkaji Number:J77.612B
Wikidata:Q27285351
Metabolomics Workbench ID:48465
Mol file:60415-61-4.mol

Synonyms:2-Pentyl butyrate;pentan-2-yl butanoate;1-Methylbutyl butanoate;60415-61-4;Butanoic acid, 1-methylbutyl ester;2-Pentyl butanoate;sec-Amyl butyrate;1-Methylbutyl butyrate;BUTYRIC ACID, sec-PENTYL ESTER;Butanoic acid, 2-pentyl ester;UNII-O5709B244U;EINECS 262-226-8;O5709B244U;AI3-33700;1-Methylbutylbutyrate;1-Methylbutyl butyrate #;2-Pentyl butyrate, >98%;SCHEMBL3099673;FEMA NO. 3893;FEMA 3893;DTXSID50866810;2-PENTYL BUTYRATE [FHFI];CHEBI:179875;LMFA07010712;2-Pentyl butyrate, analytical standard;Q27285351

Suppliers and Price of 2-Pentyl butyrate

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

Sigma-Aldrich
2-Pentyl butyrate analytical standard
1ml
$ 71.60

American Custom Chemicals Corporation
2-PENTYL BUTYRATE 95.00%
5MG
$ 495.18

Total 10 raw suppliers

Chemical Property of 2-Pentyl butyrate

Chemical Property:

Vapor Pressure:1.09mmHg at 25°C
Melting Point:-73°C (estimate)
Refractive Index:1.416
Boiling Point:176.5 °C at 760 mmHg
Flash Point:59.4 °C
PSA：26.30000
Density:0.874 g/cm³
LogP:2.51830
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:158.130679813
Heavy Atom Count:11
Complexity:110

Purity/Quality:

98%min ^*data from raw suppliers

2-Pentyl butyrate analytical standard ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 10
Safety Statements: 16

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(C)OC(=O)CCC

Technology Process of 2-Pentyl butyrate

There total 4 articles about 2-Pentyl butyrate 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: 97.2%