1-Penten-3-OL

Base Information

Chemical Name:1-Penten-3-OL
CAS No.:616-25-1
Deprecated CAS:67928-92-1
Molecular Formula:C5H10O
Molecular Weight:86.1338
Hs Code.:29052900
European Community (EC) Number:210-472-1
NSC Number:65446
UNII:DYU6Q1758M
DSSTox Substance ID:DTXSID70862293
Nikkaji Number:J77I
Wikidata:Q27162126
Metabolomics Workbench ID:44981
ChEMBL ID:CHEMBL2269086
Mol file:616-25-1.mol

Synonyms:1-penten-3-ol;1-pentene-3-ol

Suppliers and Price of 1-Penten-3-OL

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

TRC
1-Penten-3-ol
5g
$ 85.00

TCI Chemical
1-Penten-3-ol >97.0%(GC)
25mL
$ 91.00

TCI Chemical
1-Penten-3-ol >97.0%(GC)
5mL
$ 25.00

Sigma-Aldrich
1-Penten-3-ol ≥98%, FG
100 g
$ 137.00

Sigma-Aldrich
1-Penten-3-ol ≥98%, FG
100g-k
$ 137.00

Sigma-Aldrich
1-Penten-3-ol 99%
5g
$ 28.00

Sigma-Aldrich
1-Penten-3-ol ≥98%, FG
1 kg
$ 699.00

Sigma-Aldrich
1-Penten-3-ol ≥98%, FG
1kg-k
$ 699.00

Sigma-Aldrich
1-Penten-3-ol analytical standard
250mg
$ 74.30

Sigma-Aldrich
1-Penten-3-ol ≥98%,FG
1 SAMPLE-K
$ 50.00

Total 94 raw suppliers

Chemical Property of 1-Penten-3-OL

Chemical Property:

Appearance/Colour:colourless liquid
Vapor Pressure:11.2mmHg at 25°C
Melting Point:14.19°C (estimate)
Refractive Index:n20/D 1.424(lit.)
Boiling Point:112.5 °C at 760 mmHg
PKA:14.49±0.20(Predicted)
Flash Point:25 °C
PSA：20.23000
Density:0.827 g/cm³
LogP:0.94330
Storage Temp.:Flammables area
Solubility.:90.1g/l
Water Solubility.:Slightly soluble in water
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:86.073164938
Heavy Atom Count:6
Complexity:41.2

Purity/Quality:

99% ^*data from raw suppliers

1-Penten-3-ol ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 10-37-20
Safety Statements: 23-24/25-16

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Chemical Classes:Other Classes -> Alcohols and Polyols, Other
Canonical SMILES:CCC(C=C)O
Description 1-Penten-3-ol is a volatile organic compound belonging to the family of unsaturated alcohols. It has a bitter, fruity, and green taste.
Sources Naturally emitted from vegetation, particularly in response to injuries or wounds. Also found in marine products such as sardines.
Categories Classified as an unsaturated alcohol and a biogenic volatile organic compound (BVOC).
Uses Utilized for lift in cucumber, melon, berry, and vegetable accords for fragrances.
References [1] Temperature dependent kinetic study of the gas phase reaction of ozone with 1-penten-3-ol, cis-2-penten-1-ol and trans-3-hexen-1-ol: Experimental and theoretical data
DOI 10.1016/j.atmosenv.2020.117306
[2] Product investigation of the gas phase ozonolysis of 1-penten-3-ol, cis-2-penten-1-ol and trans-3-hexen-1-ol
DOI 10.1016/j.atmosenv.2020.117732

Technology Process of 1-Penten-3-OL

There total 39 articles about 1-Penten-3-OL 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: 91.0%

: 1826-67-1
vinyl magnesium bromide

: 123-38-6
propionaldehyde

: 616-25-1
1-Penten-3-ol

Guidance literature:: In tetrahydrofuran; diethyl ether; at -78 - 20 ℃; for 1h; Inert atmosphere; Schlenk technique;
DOI:10.1002/anie.201904256

Reference yield: 89.1%

: 4016-15-3
2,3-epoxypentane

: 616-25-1
1-Penten-3-ol

: 96-22-0
pentan-3-one

Guidance literature:: With magnesium bromide; In N,N-dimethyl-formamide; at 130 ℃; for 1.16667h;

Reference yield: 84.0%

: 1629-58-9
4-penten-3-one

: 616-25-1
1-Penten-3-ol

Guidance literature:: With C₃₆H₄₂Cu₆N₁₂S₆; isopropyl alcohol; sodium hydroxide; In isopropyl alcohol; at 100 ℃; for 24h; chemoselective reaction; Sealed tube; Inert atmosphere;
DOI:10.1021/acs.joc.7b02676