5-Nonanol

Base Information

• Chemical Name: 5-Nonanol
• CAS No.: 623-93-8
• Molecular Formula: C9H20 O
• Molecular Weight: 144.257
• Hs Code.: 2905199090
• European Community (EC) Number: 210-820-2
• NSC Number: 4552
• UNII: 7MKD8SMM75
• DSSTox Substance ID: DTXSID70211368
• Nikkaji Number: J96.508A
• Wikidata: Q25834690
• Metabolomics Workbench ID: 3366
• Mol file: 623-93-8.mol

Synonyms:5-NONANOL;623-93-8;Nonan-5-ol;Dibutylcarbinol;Dibutyl carbinol;AI3-04244;NSC-4552;EINECS 210-820-2;5-Nonyl Alcohol;NSC4552;Nonanol-(5);7MKD8SMM75;SCHEMBL22238;DTXSID70211368;AMY19319;NSC 4552;LMFA05000508;MFCD00021944;5-Nonanol, >=95.0% (GC);AKOS009156482;5-Nonanol, puriss., >=99.5% (GC);FT-0620728;N0337;D91684;A833756;Q25834690

Chemical Property of 5-Nonanol

Chemical Property:

• Appearance/Colour: Colorless iquid
• Vapor Pressure: 0.102mmHg at 25°C
• Melting Point: 5°C
• Refractive Index: n20/D 1.429
• Boiling Point: 196.6 °C at 760 mmHg
• PKA: 15.31±0.20(Predicted)
• Flash Point: 79.5 °C
• PSA: 20.23000
• Density: 0.821 g/mL at 20 °C(lit.)
• LogP: 2.72770
• Storage Temp.: Store below +30°C.
• Water Solubility.: Soluble in water (0.46 mg/ml at 15°C), and chloroform.
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 144.151415257
• Heavy Atom Count: 10
• Complexity: 53.7

Purity/Quality:

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

5-Nonanol >97.0%(GC) ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 23-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCC(CCCC)O
• Uses: 5-Nonanol is used as intermediates in chemical research. It is used as natural substances and extractives.

Technology Process of 5-Nonanol

There total 32 articles about 5-Nonanol 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: 100.0%

nonanone-5 (502-56-7) → 5-nonanol (623-93-8)

Guidance literature:

With C₂₈H₁₈Co^(1-)*K⁽¹⁺⁾*2C₄H₁₀O₂; hydrogen; In toluene; at 60 ℃; for 24h; under 8025.8 Torr; chemoselective reaction;

DOI:10.1002/anie.201308967

Reference yield: 99.0%

2-[(1'-butylpentyl)oxy]tetrahydro-2H-pyran (88773-86-8) → 5-nonanol (623-93-8)

Guidance literature:

Nafion-H; In methanol; for 2h;

DOI:10.1055/s-1983-30553

Reference yield: 91.0%

pentanal (110-62-3) + n-Butyl chloride (109-69-3) → 5-nonanol (623-93-8)

Guidance literature:

With tetrahydrofuran; neodymium(II) diiodide; at -15 ℃;

DOI:10.1021/ol030033u

upstream raw materials:

n-butyl magnesium bromide

pentanal

Methyl formate

butyl magnesium bromide

Downstream raw materials:

(E)-non-4-ene

nonan-5-yl acetate

5-Methoxymethoxy-nonane

5-bromononane

Refernces

• 1、 Amberchan, Gabriella,Snelling, Rachel A.,Moya, Enrique,Landi, Madison,Lutz, Kyle,Gatihi, Roxanne,Singaram, Bakthan. "Reaction of Diisobutylaluminum Borohydride, a Binary Hydride, with Selected Organic Compounds Containing Representative Functional Groups". supporting information. p. 6207 - 6227. Retrieved 2021/05/06.
• 2、 Cao, Dawei,Xia, Shumei,Pan, Pan,Zeng, Huiying,Li, Chao-Jun,Peng, Yong. "Light-driven MPV-type reduction of aryl ketones/aldehydes to alcohols with isopropanol under mild conditions". supporting information. p. 7539 - 7543. Retrieved 2021/10/12.