4-Heptenal

Base Information Edit

Chemical Name:4-Heptenal
CAS No.:929-22-6
Molecular Formula:C7H12O
Molecular Weight:112.172
Hs Code.:
European Community (EC) Number:213-198-0
UNII:WLK79PR715
DSSTox Substance ID:DTXSID801020908
Nikkaji Number:J125.019A,J298.505E
Wikidata:Q27292708
Metabolomics Workbench ID:3419
Mol file:929-22-6.mol

Synonyms:4-Heptenal;(E)-Hept-4-enal;trans-4-Heptenal;929-22-6;4-Heptenal, (E)-;4-Heptenal, (4E)-;Hept-trans-4-enal;(e)-4-heptenal;(4E)-4-Heptenal;(E)-4-hepten-1-al;UNII-WLK79PR715;WLK79PR715;cis-4-Hepten-1-al;EINECS 213-198-0;4-Heptenal, (4Z)-;(Z) - hept - 4 - enal;(4E)-4-Heptenal #;4-HEPTENAL, TRANS-;SCHEMBL241955;VVGOCOMZRGWHPI-ONEGZZNKSA-N;DTXSID801020908;LMFA06000021;AKOS006228666;cis-4-hepten-1-al FCC, No Antioxidant;Q27292708

Suppliers and Price of 4-Heptenal

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

American Custom Chemicals Corporation
TRANS-4-HEPTENAL 95.00%
5MG
$ 497.72

Total 6 raw suppliers

Chemical Property of 4-Heptenal Edit

Chemical Property:

Vapor Pressure:3.64mmHg at 25°C
Melting Point:-53.35°C (estimate)
Refractive Index:1.427
Boiling Point:151.6 °C at 760 mmHg
Flash Point:35.2 °C
PSA：17.07000
Density:0.83 g/cm³
LogP:1.93170
XLogP3:1.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:112.088815002
Heavy Atom Count:8
Complexity:74.5

Purity/Quality:

99%, ^*data from raw suppliers

TRANS-4-HEPTENAL 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC=CCCC=O
Isomeric SMILES:CC/C=C/CCC=O

Technology Process of 4-Heptenal

There total 6 articles about 4-Heptenal 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: 90.0%

: 923-53-5
3-Vinyloxy-pent-1-ene

: 929-22-6
4-cis-heptenal

Guidance literature:: at 180 ℃; for 0.5h;

Reference yield: 79.0%

: 54004-29-4
methyl trans-hept-4-enoate

: 929-22-6
4-cis-heptenal

Guidance literature:: With diisobutylaluminium hydride; In hexane; dichloromethane; at -78 ℃; for 0.333333h;
DOI:10.1021/ja047346k

Reference yield: 72.0%

: 24469-79-2
(E)-hept-4-en-1-ol

: 929-22-6
4-cis-heptenal

Guidance literature:: (E)-hept-4-en-1-ol; With oxalyl dichloride; dimethyl sulfoxide; In dichloromethane; at -78 ℃; for 0.25h; Inert atmosphere;

With triethylamine; In dichloromethane; at -78 - -40 ℃; Inert atmosphere;
DOI:10.1021/ja2069449