2-Methylnonane - CAS 871-83-0

Catalog:	BB038318
Product Name:	2-Methylnonane
CAS:	871-83-0
Synonyms:	2-methylnonane

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Computed Properties

IUPAC Name:	2-methylnonane
Description:	2-Methylnonane (CAS# 871-83-0) is used in the preparation of Tetrazolylarylsulfonamides as metallo-beta-lactamase inhibitors.
Molecular Weight:	142.28
Molecular Formula:	C10H22
Canonical SMILES:	CCCCCCCC(C)C
InChI:	InChI=1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3
InChI Key:	SGVYKUFIHHTIFL-UHFFFAOYSA-N
Boiling Point:	166-169 °C (lit.)
Density:	0.726 g/cm³
Appearance:	Liquid
LogP:	4.00290
Vapor Pressure:	1.89 [mmHg]

Publication Number	Title	Priority Date
CN-112831053-A	Reactive organosilicon release agent and preparation method thereof	20210224
CN-112831274-A	Hydrosulphonyl-terminated polysiloxane water-based release agent	20210224
CN-112336639-A	Four-layer low-viscosity liquid cosmetic without perfluorinated compounds	20201103
CN-111816857-A	Nano-silicon composite material with core-shell structure and preparation method and application thereof	20200721
CN-111816857-B	Nano-silicon composite material with core-shell structure and preparation method and application thereof	20200721

PMID	Publication Date	Title	Journal
22239960	20120203	A molecular simulation study of the effects of stationary phase and solute chain length in reversed-phase liquid chromatography	Journal of chromatography. A
22291900	20120101	Expression in antennae and reproductive organs suggests a dual role of an odorant-binding protein in two sibling Helicoverpa species	PloS one
22505951	20120101	Human biological monitoring of diisononyl phthalate and diisodecyl phthalate: a review	Journal of environmental and public health
21333643	20110601	CP47,497-C8 and JWH073, commonly found in 'Spice' herbal blends, are potent and efficacious CB(1) cannabinoid receptor agonists	European journal of pharmacology
22007163	20110101	Beyond THC: The New Generation of Cannabinoid Designer Drugs	Frontiers in behavioral neuroscience

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Related Functional Groups

Other Alkanes

[112-95-8]
Eicosane
[629-59-4]
Tetradecane
[629-78-7]
Heptadecane
[871-83-0]
2-Methylnonane
[14167-59-0]
Tetratriacontane
[638-67-5]
Tricosane

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GHS Hazard Statement:	H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P280, P301+P310, P303+P361+P353, P331, P370+P378, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	55.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	142.172150702
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	142.172150702
Rotatable Bond Count:	6
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.3