1-Heptadecene

Base Information

• Chemical Name: 1-Heptadecene
• CAS No.: 6765-39-5
• Deprecated CAS: 1616790-37-4,67774-72-5,67774-73-6
• Molecular Formula: C17H34
• Molecular Weight: 238.457
• Hs Code.: 2901299090
• European Community (EC) Number: 247-567-2,229-825-6,265-207-2
• NSC Number: 77132
• UNII: P33057D09T
• DSSTox Substance ID: DTXSID00873236
• Nikkaji Number: J621A
• Wikidata: Q27104917
• Metabolomics Workbench ID: 5016
• Mol file: 6765-39-5.mol

Synonyms:1-HEPTADECENE;heptadec-1-ene;6765-39-5;HEPTADECENE;Hexahydroaplotaxene;NSC 77132;26266-05-7;UNII-P33057D09T;EINECS 229-825-6;EINECS 247-567-2;EINECS 265-207-2;NSC-77132;P33057D09T;64743-02-8;AI3-36483;C17-H34;heptadecen;MFCD00009000;C30-38 olefin;1-Heptadecene, 98%;UNII-04DAD0KDZ0;04DAD0KDZ0;Alkenes, C$10 alpha-Alkenes;CHEBI:64502;DTXSID00873236;NSC77132;C17H34;LMFA11000318;AKOS015912747;1-heptadecene [standard material for gc];FT-0607874;H0372;S0347;D90849;Q27104917

Chemical Property of 1-Heptadecene

Chemical Property:

• Appearance/Colour: Clear pale yellow liquid
• Melting Point: 10-11 °C(lit.)
• Refractive Index: n20/D 1.441(lit.)
• Boiling Point: 157-159 °C11 mm Hg(lit.)
• Flash Point: 230 °F
• PSA: 0.00000
• Density: 0.785 g/mL at 25 °C(lit.)
• LogP: 6.65370
• XLogP3: 9.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 14
• Exact Mass: 238.266051085
• Heavy Atom Count: 17
• Complexity: 137

Purity/Quality:

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

1-Heptadecene [Standard Material for GC] >99.5%(GC) ^*data from reagent suppliers

Safty Information:

• Safety Statements: 23-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: UVCB,Other Classes -> Aliphatics,Unsaturated
• Canonical SMILES: CCCCCCCCCCCCCCCC=C

Technology Process of 1-Heptadecene

There total 40 articles about 1-Heptadecene 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: 94.0%

[((E)-Heptadec-1-ene)-1-sulfonyl]-benzene (137170-76-4) → heptadec-1-ene (6765-39-5)

Guidance literature:

With disodium telluride;

DOI:10.1016/S0040-4039(01)80699-7

Reference yield: 84.0%

stearic acid (57-11-4) → heptadec-1-ene (6765-39-5)

Guidance literature:

With bis(triphenylphosphine)iridium(I) carbonyl chloride; acetic anhydride; potassium iodide; at 160 ℃; for 5h; Inert atmosphere;

DOI:10.1021/om1009268

Reference yield: 75.0%

2-cyclohexylacetylene (931-48-6) + Stearoyl chloride (112-76-5) → heptadec-1-ene (6765-39-5) + C26H47ClO (1367369-82-1)

Guidance literature:

With bis(2-methylphenyl)dicyclohexylphosphane; bis(1,5-cyclooctadiene)diiridium(I) dichloride; In toluene; at 60 ℃; for 20h; optical yield given as %de; stereoselective reaction; Inert atmosphere;

DOI:10.1021/ja209679c

upstream raw materials:

N-heptadecylaniline

tetradecylmagnesium bromide

allyl bromide

1-methanesulfinyl-heptadecane

Downstream raw materials:

C₂₆H₄₃NO₄S

C₂₆H₄₅NO₄S

2-pentadecanyloxirane

n-heptadecanal

Refernces

• 1、 Chen, Hao,Chen, Kequan,Fu, Jie,Li, Yafei,Liu, Jixing,Liu, Miaomiao,Lu, Xiuyang,Okejiri, Francis,Ouyang, Pingkai,Zhang, Zihao. "Highly selective production of linear 1-heptadecene from stearic acid over a partially reduced MoO: X catalyst". . p. 4456 - 4459. Retrieved 2020.
• 2、 Bitter, Harry,Fuertes, Sara,Henao, Wilson,Ochoa, Elba,Pinilla, Jose Luis,Scott, Elinor,Suelves, Isabel,Torres, Daniel,Van Haasterecht, Tomas. "Synthesis and characterization of a supported Pd complex on carbon nanofibers for the selective decarbonylation of stearic acid to 1-heptadecene: The importance of subnanometric Pd dispersion". . p. 2970 - 2985. Retrieved 2020/06/17.