n-Nonane

Product Information

Molecular Formula:
C9H20
Molecular Weight:
128.25
Description
N-nonane appears as a clear colorless liquid with a sharp odor. Flash point 86 °F. Insoluble in water and less dense than water. Contact may irritate eyes and possibly injury the cornea. May irritate skin. Vapor inhalation may cause irritation. Prolonged inhalation may lead to breathing difficulty. Ingestion causes abdominal discomfort, nausea and diarrhea.
Synonyms
n-C9H20; nonanes; nonylhydride; Shellsol 140; shellsol140; 'LGC' (2032); ALKANE C9; N-NONANE
IUPAC Name
nonane
Canonical SMILES
CCCCCCCCC
InChI
InChI=1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3
InChI Key
BKIMMITUMNQMOS-UHFFFAOYSA-N
Boiling Point
151 °C (lit.)
Melting Point
−53 °C (lit.)
Flash Point
87.8 °F - closed cup
Purity
>99.5%(GC)
Density
0.718
Solubility
water, 0.4058 mg/L @ 25 °C (est)
Appearance
A clear colorless liquid with a sharp odor. Flash point 86°F. Insoluble in water and less dense than water. Contact may irritate eyes and possibly injury the cornea. May irritate skin. Vapor inhalation may cause irritation. Prolonged inhalation may
Application
Used as solvents, in jet fuel research, the manufacture of paraffin products, a component of gasoline, in organic synthesis, as a distillation chaser, and in biodegradable detergents; Major ingredients in VM & P naphtha and Stoddard solvents.
Storage
Flammables area
Refractive Index
n20/D 1.405 (lit.)
Stability
Stable. Highly flammable. Incompatible with strong oxidizing agents.
LogP
log Kow = 5.65
Vapor Pressure
3.22 mmHg at 68 °F
Henry's Law Constant
3.40 atm-cu m/mol at 25 °C (est)
Decomposition
When heated to decomposition it emits acrid smoke and irritating fumes.
Odor
Gasoline-like odor

Safety Information

Hazards
H226 - H304 - H315 - H336 - H410
Precautionary Statement
P210 - P273 - P301 + P310 + P331 - P302 + P352

Computed Properties

XLogP3
4.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
6
Exact Mass
128.156500638 g/mol
Monoisotopic Mass
128.156500638 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
33.3
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
TW-201815788-A a useful compound as a colorant 2016-09-06
CN-106543909-A A kind of cloth bridging arrangement and its technique 2015-09-23
US-9217098-B1 Electroinitiated polymerization of compositions having a 1,1-disubstituted alkene compound 2015-06-01
US-9123387-B1 Magnetic recording drives with active photocatalytic filtration 2014-08-21
EP-2960256-A1 Catalyst component for the preparation of nucleated polyolefins 2014-06-27
EP-2960257-A1 Improved process for preparing a particulate olefin polymerisation catalyst component 2014-06-27
EP-2960279-A1 Nucleated polypropylene composition 2014-06-27
US-2015375176-A1 Membrane filter 2014-06-27
WO-2015197434-A1 Nucleated polypropylene composition 2014-06-27
WO-2015197435-A1 Improved process for preparing a particulate olefin polymerisation catalyst component 2014-06-27

Literatures

PMID Publication Date Title Journal
28003437 2017-04-01 Editor's Highlight: Prospective Analyses of Volatile Organic Compounds in Obstructive Sleep Apnea Patients Toxicological sciences : an official journal of the Society of Toxicology
23031697 2012-10-01 Water uptake of poly(2-N-alkyl-2-oxazoline)s: temperature-dependent Fourier transform infrared (FT-IR) spectroscopy and two-dimensional correlation analysis (2DCOS) Applied spectroscopy
22967626 2012-09-15 Characterizing the gas phase ion chemistry of an ion trap mobility spectrometry based explosive trace detector using a tandem mass spectrometer Talanta
22835687 2012-09-07 Allergic asthma exhaled breath metabolome: a challenge for comprehensive two-dimensional gas chromatography Journal of chromatography. A
22881445 2012-09-01 Characterising surface energy of pharmaceutical powders by inverse gas chromatography at finite dilution The Journal of pharmacy and pharmacology
22860512 2012-08-29 Electronic structure of an [FeFe] hydrogenase model complex in solution revealed by X-ray absorption spectroscopy using narrow-band emission detection Journal of the American Chemical Society
22595649 2012-08-01 Interleukin-6 signaling regulates anchorage-independent growth, proliferation, adhesion and invasion in human ovarian cancer cells Cytokine
22618127 2012-08-01 Genetics of epilepsy and relevance to current practice Current neurology and neuroscience reports
22653868 2012-08-01 Intramolecular [2+2] photocycloaddition reactions as an entry to the 2-oxatricyclo[4.2.1.0(4,9)]nonan-3-one skeleton of lactiflorin Chemistry, an Asian journal
22883647 2012-08-01 Diagnostic accuracy of non-echo-planar diffusion-weighted MRI versus other MRI sequences in cholesteatoma Journal of medical imaging and radiation oncology
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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