Pentyl valerate

Base Information

Chemical Name:Pentyl valerate
CAS No.:2173-56-0
Molecular Formula:C10H20O2
Molecular Weight:172.268
Hs Code.:29156000
European Community (EC) Number:218-528-7
NSC Number:76414
UNII:694D4BU139
DSSTox Substance ID:DTXSID8042218
Nikkaji Number:J102.391H
Wikipedia:Pentyl_pentanoate
Wikidata:Q3374901
Metabolomics Workbench ID:130677
ChEMBL ID:CHEMBL3187606
Mol file:2173-56-0.mol

Synonyms:Pentyl valerate;Amyl valerate;2173-56-0;Pentyl pentanoate;n-Pentyl valerate;Pentanoic acid, pentyl ester;Amyl valerianate;Valeric acid, pentyl ester;1-Pentyl n-valerate;Pentanoic Acid Pentyl Ester;Valeric Acid Pentyl Ester;NSC 76414;DTXSID8042218;EINECS 218-528-7;NSC-76414;694D4BU139;BRN 1754427;AI3-01269;Amyl Pentanoate;Amylvalerianat;pentyl pentenoate;N-Amyl N-valerate;MFCD00042904;Pentanoicacid,pentyl ester;SCHEMBL329057;Pentyl ester of pentanoic acid;CHEMBL3187606;DTXCID6022218;UNII-694D4BU139;CAA17356;NSC76414;Tox21_302212;Pentyl valerate, >=97.0% (GC);AKOS015903246;NCGC00255847-01;CAS-2173-56-0;LS-101858;FT-0686711;P1929;4-02-00-00872 (Beilstein Handbook Reference);J-014260;Q3374901

Suppliers and Price of Pentyl valerate

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

TCI Chemical
Pentyl Valerate >98.0%(GC)
25mL
$ 25.00

TCI Chemical
Pentyl Valerate >98.0%(GC)
500mL
$ 170.00

Sigma-Aldrich
Pentyl valerate ≥97.0% (GC)
100ml
$ 58.50

American Custom Chemicals Corporation
AMYL VALERATE 95.00%
100ML
$ 2360.94

AK Scientific
Pentyl Valerate
500ml
$ 276.00

AK Scientific
Pentyl Valerate
500ml
$ 207.00

Total 35 raw suppliers

Chemical Property of Pentyl valerate

Chemical Property:

Vapor Pressure:0.233mmHg at 25°C
Melting Point:-78.8°C
Refractive Index:n20/D 1.417
Boiling Point:206.8 °C at 760 mmHg
Flash Point:76.5 °C
PSA：26.30000
Density:0.874 g/cm³
LogP:2.91000
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:172.146329876
Heavy Atom Count:12
Complexity:110

Purity/Quality:

99.9% ^*data from raw suppliers

Pentyl Valerate >98.0%(GC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Safety Statements: 23-24/25

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCOC(=O)CCCC

Technology Process of Pentyl valerate

There total 35 articles about Pentyl valerate 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: 99.0%

: 71-41-0
pentan-1-ol

: 109-52-4
valeric acid

: 2173-56-0
n-pentyl n-pentanoate

Guidance literature:: With hafnium tetrakis(trifluoromethanesulfonate); In toluene; at 110 ℃; for 24h; Reagent/catalyst;
DOI:10.1021/acscatal.5b00082