2-Methylnonane

Base Information

• Chemical Name: 2-Methylnonane
• CAS No.: 871-83-0
• Molecular Formula: C10H22
• Molecular Weight: 142.285
• European Community (EC) Number: 252-052-0,212-814-5,271-365-3
• NSC Number: 24849
• UNII: 382AKH052V
• DSSTox Substance ID: DTXSID80873239
• Nikkaji Number: J95.545K
• Wikidata: Q2813818
• Metabolomics Workbench ID: 5310
• Mol file: 871-83-0.mol

Synonyms:2-METHYLNONANE;871-83-0;Nonane, 2-methyl-;2 - methylnonane;C9-11 Isoparaffin;Octane, dimethyl-;ISODECANE;EINECS 271-365-3;68551-16-6;UNII-382AKH052V;382AKH052V;EINECS 212-814-5;EINECS 252-052-0;NSC 24849;NSC-24849;34464-38-5;63335-88-6;iso-decane;2-methyl nonane;2-methyl-nonane;Isoalcanos, c9-11;C10-13 Isoparaffin;UNII-UQ7SPY0IRF;UQ7SPY0IRF;METHYLNONANE, 2-;DTXSID80873239;NSC24849;EINECS 271-366-9;BBL103998;LMFA11000615;MFCD00027321;STL557809;2-Methylnonane, >=99.0% (GC);AKOS015841666;LS-195631;FT-0633043;M0281;D91304;Q2813818

Chemical Property of 2-Methylnonane

Chemical Property:

• Melting Point: -74.65°C
• Refractive Index: n20/D 1.410
• Boiling Point: 166-169 °C(lit.)
• Flash Point: 46°C
• PSA: 0.00000
• Density: 0.726 g/mL at 20 °C(lit.)
• LogP: 4.00290
• Solubility.: soluble in Chloroform,Ether,Benzene
• 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: 55.1

Purity/Quality:

96% 1H NMR ^*data from raw suppliers

2-Methylnonane >99.0%(GC) ^*data from reagent suppliers

Safty Information:

• Statements: 10
• Safety Statements: 16

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: UVCB,Solvents -> Aliphatics,Saturated ( Aliphatics,Saturated (>C11)
• Canonical SMILES: CCCCCCCC(C)C

Technology Process of 2-Methylnonane

There total 20 articles about 2-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: 80.0%

methyllithium (917-54-4) + 1,1-diiodooctane (66225-22-7) → isodecane (871-83-0)

Guidance literature:

With CuCN; In tetrahydrofuran; Ambient temperature;

DOI:10.1055/s-1993-25995

Reference yield: 60.0%

1,1-difluorooctane (109317-99-9) → isodecane (871-83-0)

Guidance literature:

In tetrahydrofuran; at -78 ℃; for 12h;

DOI:10.1016/S0040-4020(01)89331-5

Reference yield:

hepatdecane (629-78-7) + octadecane (593-45-3) + n-nonadecane (629-92-5) → 2-methylheptane (592-27-8) + isodecane (871-83-0) + ethanol (64-17-5) + 3-methylheptane (589-81-1) + Isobutane (75-28-5,40921-86-6) + methylbutane (78-78-4) + 2-Methylpentane (107-83-5) + n-heptane (142-82-5) + 3-methyloctane (2216-33-3,116783-15-4) + Hexadecane (544-76-3) + 4-methylhexadecane (25117-26-4) + 4-methylheptadecane (26429-11-8) + 2-methylheptadecane (1560-89-0) + 4-ethyltetradecane (55045-14-2)

Guidance literature:

With hydrogen; Ni 55/5 P catalyst; mordenite zeolite; at 300 ℃; for 5h; under 78334.3 - 104192 Torr; Product distribution / selectivity;

upstream raw materials:

2-methyl-nonan-3-ol

decane

4-methylnonane

3-methyl-nonane

Downstream raw materials:

4-methylnonane

3-methyl-nonane

propane

hexane

Refernces

• 1、 Chatterjee, Indranil,Oestreich, Martin. "Br?nsted Acid-Catalyzed Transfer Hydrogenation of Imines and Alkenes Using Cyclohexa-1,4-dienes as Dihydrogen Surrogates". supporting information. p. 2463 - 2466. Retrieved 2016/06/09.
• 2、 Chatterjee, Indranil,Qu, Zheng-Wang,Grimme, Stefan,Oestreich, Martin. "B(C6F5)3-Catalyzed Transfer of Dihydrogen from One Unsaturated Hydrocarbon to Another". supporting information. p. 12158 - 12162. Retrieved 2015/10/12.