5-Methylnonane

Base Information

• Chemical Name: 5-Methylnonane
• CAS No.: 15869-85-9
• Molecular Formula: C10H22
• Molecular Weight: 142.285
• Hs Code.: 2901100000
• European Community (EC) Number: 678-597-8
• DSSTox Substance ID: DTXSID2065961
• Nikkaji Number: J130.649I
• Wikidata: Q2817107
• Metabolomics Workbench ID: 5314
• Mol file: 15869-85-9.mol

Synonyms:5-METHYLNONANE;15869-85-9;Nonane, 5-methyl-;5-methyl nonane;5-methyl-nonane;DTXSID2065961;LMFA11000619;MFCD00048832;FT-0692790;M0284;T71863;Q2817107

Chemical Property of 5-Methylnonane

Chemical Property:

• Boiling Point: 164.9°Cat760mmHg
• Flash Point: 37.2°C
• PSA: 0.00000
• Density: 0.733g/cm³
• LogP: 4.00290
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 6
• Exact Mass: 142.172150702
• Heavy Atom Count: 10
• Complexity: 49.1

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C)CCCC

Technology Process of 5-Methylnonane

There total 4 articles about 5-Methylnonane 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:

decane (124-18-5) → 5-methylnonane (15869-85-9) + isodecane (871-83-0) + 4-methylnonane (17301-94-9,108266-42-8) + 3-methyl-nonane (5911-04-6)

Guidance literature:

zeolite SSZ-53; Further Variations:; Temperatures; Product distribution; atmospheric pressure;

DOI:10.1002/anie.200701634

Reference yield:

1-hexene (592-41-6,25067-06-5) + ethene (74-85-1) → octane, 4-ethyl- (15869-86-0) + decane (124-18-5) + 5-methylnonane (15869-85-9)

Guidance literature:

1-hexene; ethene; With C₂₉H₃₁Cl₃CrNO₄P₂; In chlorobenzene; at 20 ℃; under 760.051 Torr;

With palladium on activated charcoal; hydrogen; In chlorobenzene; Inert atmosphere;

DOI:10.1021/om300492r

Reference yield:

cis-decahydronaphthalene → trans-bicyclo[4.4.0]decane + 3,4-diethylhexane (19398-77-7) + octane, 4-ethyl- (15869-86-0) + 5,5-dimethyloctane (15869-96-2) + decane (124-18-5) + 5-methylnonane (15869-85-9) + 4-methyloctane (2216-34-4) + 3-ethylheptane (15869-80-4) + 4-ethyl-3-methylheptane (52896-89-6) + 4-(1-methylethyl)-heptane (52896-87-4)

Guidance literature:

With 2.59 wt.% iridium on non-acidic silica; hydrogen; at 290 ℃; under 39003.9 Torr; Autoclave;

DOI:10.1016/j.apcata.2012.03.010

upstream raw materials:

5-methyl-nonanal

decane

1-hexene

ethene

Downstream raw materials:

formic acid

acetic acid

butyric acid

2-butylhexan-1-ol

Refernces

• 1、 Haas, Andreas,Rabl, Sandra,Ferrari, Marco,Calemma, Vincenzo,Weitkamp, Jens. "Ring opening of decalin via hydrogenolysis on Ir/- and Pt/silica catalysts". experimental part. p. 97 - 109. Retrieved 2012/07/13.
• 2、 Yilmaz, Bilge,Mueller, Ulrich,Tijsebaert, Bart,Vos, Dirk De,Xie, Bin,Xiao, Feng-Shou,Gies, Hermann,Zhang, Weiping,Bao, Xinhe,Imai, Hiroyuki,Tatsumi, Takashi. "Al-RUB-41: A shape-selective zeolite catalyst from a layered silicate". supporting information; experimental part. p. 1812 - 1814. Retrieved 2011/03/22.