5-Dodecen-1-ol, acetate, (Z)-

Base Information

• Chemical Name: 5-Dodecen-1-ol, acetate, (Z)-
• CAS No.: 16676-96-3
• Molecular Formula: C14H26 O2
• Molecular Weight: 226.359
• Hs Code.: 2915390090
• European Community (EC) Number: 240-724-6
• UNII: 3212656JW4
• DSSTox Substance ID: DTXSID30860816
• Nikkaji Number: J647E
• Wikidata: Q27256113
• Metabolomics Workbench ID: 3888
• Mol file: 16676-96-3.mol

Synonyms:16676-96-3;5-Dodecen-1-ol, acetate, (Z)-;5Z-Dodecenyl acetate;[(Z)-dodec-5-enyl] acetate;5-Dodecen-1-ol, 1-acetate, (5Z)-;1-Acetoxy-5-dodecene, (5Z)-;5-Dodecen-1-ol, acetate, (5Z)-;Z-5-dodecenyl acetate;5(Z)-Dodecenyl acetate;(z)-5-dodecenyl acetate;UNII-3212656JW4;EINECS 240-724-6;AI3-33458;3212656JW4;(Z)-Dodec-5-enyl acetate;(Z)-5-DODECEN-1-YL ACETATE;(5Z)-5-Dodecenyl acetate;Z-5-Dodecen-1-yl acetate;(5Z)-1-acetoxy-5-dodecene;SCHEMBL593188;FEMA NO. 4841;5-Dodecen-1-ol acetate, (Z);DTXSID30860816;CHEBI:179335;FOEWNRTZASNZJY-HJWRWDBZSA-N;Acetic acid (Z)-5-dodecenyl ester;5-DODECENYL ACETATE, (Z)-;LMFA07010243;(Z)-5-DODECEN-1-OL ACETATE;DODECEN-1-YL ACETATE, (Z)-5-;5Z-Dodecenyl acetate CAS 16676-96-3;Q27256113

Chemical Property of 5-Dodecen-1-ol, acetate, (Z)-

Chemical Property:

• Vapor Pressure: 0.00114mmHg at 25°C
• Boiling Point: 300.1°Cat760mmHg
• Flash Point: 96.5°C
• PSA: 26.30000
• Density: 0.881g/cm³
• LogP: 4.24640
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 11
• Exact Mass: 226.193280068
• Heavy Atom Count: 16
• Complexity: 185

Purity/Quality:

93% ^*data from raw suppliers

(5Z)-DodecenylAcetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC=CCCCCOC(=O)C
• Isomeric SMILES: CCCCCC/C=C\CCCCOC(=O)C
• Uses: (5Z)-Dodecenyl Acetate is derived from 5-Hexyn-1-ol (H325250), which is used as a starting material in the synthesis of lactones with terminal alkyne groups, as well as other terminal alkynes.

Technology Process of 5-Dodecen-1-ol, acetate, (Z)-

There total 13 articles about 5-Dodecen-1-ol, acetate, (Z)- 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: 96.0%

(Z)-dodec-5-ene-1-ol (40642-38-4) + acetic anhydride (108-24-7) → (Z)-5-dodecen-1-yl acetate (16676-96-3)

Guidance literature:

With pyridine; for 24h; Ambient temperature;

Reference yield: 85.0%

(Z)-dodec-5-ene-1-ol (40642-38-4) + acetyl chloride (75-36-5) → (Z)-5-dodecen-1-yl acetate (16676-96-3)

Guidance literature:

With pyridine; In benzene; at 20 ℃;

Reference yield:

(Z)-dodec-5-enal (68820-33-7) → (Z)-5-dodecen-1-yl acetate (16676-96-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 87 percent / LiAlH₄ / diethyl ether / 20 °C

2: 85 percent / pyridine / benzene / 20 °C

With pyridine; lithium aluminium tetrahydride; In diethyl ether; benzene;

upstream raw materials:

(Z)-dodec-5-ene-1-ol

acetic anhydride

acetyl chloride

(Z)-dodec-5-enal