trans-2-Octenoic acid

Base Information Edit

Chemical Name:trans-2-Octenoic acid
CAS No.:1871-67-6
Molecular Formula:C8H14O2
Molecular Weight:142.198
Hs Code.:2916199590
European Community (EC) Number:217-491-4,216-001-6
UNII:C0057TJ59E
DSSTox Substance ID:DTXSID50904721
Nikkaji Number:J98.019F,J98.020J
Wikidata:Q27159230
Metabolomics Workbench ID:453
ChEMBL ID:CHEMBL4277871
Mol file:1871-67-6.mol

Synonyms:trans-2-Octenoic acid;2-Octenoic acid;1871-67-6;(E)-oct-2-enoic acid;(E)-2-Octenoic acid;2-Octenoic acid, (2E)-;1470-50-4;2-Octenoic acid, (E)-;2E-octenoic acid;(2E)-2-Octenoic acid;trans-alpha-octenoic acid;(2E)-oct-2-enoic acid;Oct-2-enoic acid;Oct-2-enoic acid (E);UNII-C0057TJ59E;C0057TJ59E;EINECS 216-001-6;EINECS 217-491-4;(E)-Oct-2-enoate;2-Octenoate;C8:1n-6;trans-2-Octenoate;(E)-2-Octenoate;MFCD00002706;starbld0000560;2-Octenoic acid, trans-;2-Octenoic acid, 85%;bmse000616;(2E)-2-Octenoic acid #;SCHEMBL192604;?TRANS-2-OCTENOIC ACID;CHEMBL4277871;FEMA NO. 3957;CHEBI:86544;DTXSID50904721;LMFA01030018;NSC 66570;s6162;(E)-2-OCTENOIC ACID [FHFI];AKOS006223032;HY-W046906;2-Octenoic acid, technical grade, 85%;BS-23869;CS-0098436;O0004;EN300-805053;A813440;A902952;J-012043;Q27159230

Suppliers and Price of trans-2-Octenoic acid

Supply Marketing:Edit

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
trans-2-Octenoic Acid
100mg
$ 50.00

TRC
trans-2-Octenoic Acid
1g
$ 85.00

TCI Chemical
trans-2-Octenoic Acid >98.0%(T)
10mL
$ 45.00

Sigma-Aldrich
2-Octenoic acid technical grade, 85%
5g
$ 67.80

ChemScene
(E)-Oct-2-enoicacid
10g
$ 72.00

Chem-Impex
trans-2-Octenoicacid,98%(Assaybytitration) 98%(Assaybytitration)
10ML
$ 50.40

Alfa Aesar
trans-2-Octenoic acid 94%
50g
$ 174.00

Alfa Aesar
trans-2-Octenoic acid 94%
10g
$ 48.00

Total 31 raw suppliers

Chemical Property of trans-2-Octenoic acid Edit

Chemical Property:

Appearance/Colour:CLEAR COLOURLESS TO SLIGHTLY YELLOW LIQUID
Vapor Pressure:0.0037mmHg at 25°C
Melting Point:5-6 °C(lit.)
Refractive Index:n20/D 1.4588(lit.)
Boiling Point:260.2 °C at 760 mmHg
PKA:4.78±0.10(Predicted)
Flash Point:151.1 °C
PSA：37.30000
Density:0.955 g/cm³
LogP:2.20750
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:142.099379685
Heavy Atom Count:10
Complexity:116

Purity/Quality:

98%,99%, ^*data from raw suppliers

trans-2-Octenoic Acid ^*data from reagent suppliers

Safty Information:

Pictogram(s): C
Hazard Codes:C
Statements: 34
Safety Statements: 26-27-28-36/37/39-45

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC=CC(=O)O
Isomeric SMILES:CCCCC/C=C/C(=O)O

Technology Process of trans-2-Octenoic acid

There total 30 articles about trans-2-Octenoic acid 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: 100.0%

: 3095-95-2
diethylphosphonoacetic acid

: 66-25-1
hexanal

: 1871-67-6
(E)-oct-2-enoic acid

Guidance literature:: With N,N,N,N,-tetramethylethylenediamine; zinc trifluoromethanesulfonate; 1,8-diazabicyclo[5.4.0]undec-7-ene; In tetrahydrofuran; at 25 ℃; for 12h;
DOI:10.1055/s-2006-950292

Reference yield: 100.0%

: 176247-34-0
benzyl (E)-oct-2-enoate

: 1871-67-6
(E)-oct-2-enoic acid

Guidance literature:: With palladium 10% on activated carbon; hydrogen; In methanol; for 8h; under 2585.81 Torr;
DOI:10.1007/s00253-015-6984-4

Reference yield: 93.0%

: 124-07-2
Octanoic acid

: 1871-67-6
(E)-oct-2-enoic acid

Guidance literature:: Octanoic acid; With Zn(2,2,6,6-tetramethylpiperidine)_2*2LiCl; zinc(II) chloride; In tetrahydrofuran; at -40 ℃; for 1.5h; Inert atmosphere; Sealed tube;

With bis(η3-allyl-μ-chloropalladium(II)); Allyl acetate; In tetrahydrofuran; at -40 - 60 ℃; for 12h; diastereoselective reaction; Inert atmosphere; Sealed tube;
DOI:10.1002/anie.201706893