Nonan-1-ol

Base Information

• Chemical Name: Nonan-1-ol
• CAS No.: 143-08-8
• Molecular Formula: C9H20O
• Molecular Weight: 144.257
• Hs Code.: 2905 19 00
• European Community (EC) Number: 205-583-7,249-048-6
• NSC Number: 5521
• UN Number: 3082
• UNII: NGK73Q6XMC
• DSSTox Substance ID: DTXSID6022008
• Nikkaji Number: J2.549F
• Wikipedia: 1-Nonanol
• Wikidata: Q161662
• Metabolomics Workbench ID: 3183
• ChEMBL ID: CHEMBL24563
• Mol file: 143-08-8.mol

Synonyms:1-nonanol

Chemical Property of Nonan-1-ol

Chemical Property:

• Appearance/Colour: colourless to light yellow liquid
• Vapor Pressure: 13 mm Hg ( 104 °C)
• Melting Point: ?8-?6°C(lit.)
• Refractive Index: n20/D 1.433(lit.)
• Boiling Point: 211.617 °C at 760 mmHg
• PKA: 15.22±0.10(Predicted)
• Flash Point: 97.778 °C
• PSA: 20.23000
• Density: 0.826 g/cm³
• LogP: 2.72930
• Storage Temp.: Store below +30°C.
• Solubility.: 69.54mg/l
• Water Solubility.: 1 g/L (20 ºC)
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 144.151415257
• Heavy Atom Count: 10
• Complexity: 52.7
• Transport DOT Label: Class 9

Purity/Quality:

98%, ^*data from raw suppliers

1-Nonanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn, N
• Hazard Codes: Xn,N,Xi
• Statements: 20-51/53-36
• Safety Statements: 23-24/25-61-29-39-26-25

MSDS Files:

Useful:

• Chemical Classes: Solvents -> Alcohols (
• Canonical SMILES: CCCCCCCCCO
• Description: 1-Nonanol is a straight chain fatty alcohol with nine carbon atoms and the molecular formula CH3(CH2)8OH. It is a colorless to slightly yellow liquid with a citrus odor similar to citronella oil. Nonanol occurs naturally in the orange oil. The primary use of nonanol is in the manufacture of artificial lemon oil. Various esters of nonanol, such as nonyl acetate, are used in perfumery and flavors. Nonanol floats on water and its freezing point 23°F. Nonyl alcohol has a characteristic rose-orange odor and a slightly fatty, bitter taste reminiscent of orange. May be synthesized by reduction of ethyl pelargonate; from heptaldehyde via heptanol and heptylmagnesium bromide with ethylene oxide.
• Uses: 1-Nonanol is an chain fatty acid alcohol that naturally occurs in oil of orange. 1-Nonanol is used in the manufacture of artificial lemon oil. In manufacture of artificial lemon oil.

Technology Process of Nonan-1-ol

There total 204 articles about Nonan-1-ol 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: 3.0%

2-nonyn-1-ol (5921-73-3) → (Z)-2-nonen-1-ol (41453-56-9) + nonyl alcohol (143-08-8)

Guidance literature:

With hydrido(triphenylphosphine)copper(I) hexamer; water; In benzene; at 80 ℃; for 1h;

DOI:10.1016/S0040-4039(00)97371-4

Reference yield:

water (7732-18-5) + potassium cyanide (151-50-8) + 1-(n-nonyloxy)pyridinium iodide (87041-11-0) → pyridine-4-carbonitrile (100-48-1) + nonyl alcohol (143-08-8)

Guidance literature:

DOI:10.1021/ja01524a046

Reference yield:

(2R,3S,4S,5R,6R)-2-Hydroxymethyl-6-nonyloxy-tetrahydro-pyran-3,4,5-triol (69984-73-2,76265-96-8) → β-D-glucose (492-61-5) + nonyl alcohol (143-08-8)

Guidance literature:

With water; at 50 ℃; Equilibrium constant; Enzymatic reaction;

DOI:10.1016/S1872-2067(11)60333-1

upstream raw materials:

oxirane

n-heptylmagnesium bromide

methanol

oct-1-ene

Downstream raw materials:

dinonyl phthalate

phthalic acid monononyl ester

nonyl acetate

n-nonyl benzoate