Cyclohexylallene - CAS 5664-17-5

Catalog:	BB029442
Product Name:	Cyclohexylallene
CAS:	5664-17-5
Synonyms:	propa-1,2-dienylcyclohexane

Technical Data

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Computed Properties

Description:	Cyclohexylallene (CAS# 5664-17-5 ) is a useful research chemical.
Molecular Weight:	122.21
Molecular Formula:	C9H14
Canonical SMILES:	C=C=CC1CCCCC1
InChI:	InChI=1S/C9H14/c1-2-6-9-7-4-3-5-8-9/h6,9H,1,3-5,7-8H2
InChI Key:	CQHBBSICMXUMIB-UHFFFAOYSA-N
Boiling Point:	162.3 °C at 760 mmHg
Density:	0.857 g/cm³
MDL:	MFCD00190199
LogP:	2.90780

Publication Number	Title	Priority Date
CN-107075123-B	Polysiloxane-polycarbonate copolymer and method for producing same	20141016
WO-2012052457-A1	Method of sintering a composition	20101019
JP-2011207915-A	Epoxy group-containing compound	20100326
JP-5544972-B2	Epoxy resin composition	20100326
JP-2011157460-A	Epoxy group-containing compound	20100201

PMID	Publication Date	Title	Journal
14531683	20031015	Nickel-catalyzed highly regio- and stereoselective three-component assembly of allenes, aryl iodides, and alkenylzirconium reagents	Journal of the American Chemical Society
12398495	20021101	Highly regio- and chemoselective [2 + 2 + 2] cycloaddition of electron-deficient diynes with allenes catalyzed by nickel complexes: a novel entry to polysubstituted benzene derivatives	The Journal of organic chemistry
11777445	20020111	Palladium-catalyzed three-component assembling of allenes, organic halides, and arylboronic acids	The Journal of organic chemistry

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GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P273, P280, P303+P361+P353, P370+P378, P391, P403+P235, and P501
Signal Word:	Warning

Complexity:	112
Compound Is Canonicalized:	No
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	122.109550447
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	122.109550447
Rotatable Bond Count:	1
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2