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CYCLOHEXALALLENE

CAS No.:
5664-17-5
Catalog Number:
AG00EFT4
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00EFT4
Chemical Name:
CYCLOHEXALALLENE
CAS Number:
5664-17-5
MDL Number:
MFCD00190199
IUPAC Name:
propa-1,2-dienylcyclohexane
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
Properties
Complexity:
112  
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.11g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.211g/mol
Monoisotopic Mass:
122.11g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Literature
Title Journal
Nickel-catalyzed highly regio- and stereoselective three-component assembly of allenes, aryl iodides, and alkenylzirconium reagents. Journal of the American Chemical Society 20031015
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 20021101
Palladium-catalyzed three-component assembling of allenes, organic halides, and arylboronic acids. The Journal of organic chemistry 20020111
Properties