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Home Other Building Blocks Ethynylcyclohexane

Ethynylcyclohexane

CAS No.:
931-48-6
Catalog Number:
AG00397I
Molecular Formula:
C8H12
Molecular Weight:
108.1809
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%(GC)
In Stock USA
United States
$87
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Product Description
Catalog Number:
AG00397I
Chemical Name:
Ethynylcyclohexane
CAS Number:
931-48-6
Molecular Formula:
C8H12
Molecular Weight:
108.1809
MDL Number:
MFCD00001513
IUPAC Name:
ethynylcyclohexane
InChI:
InChI=1S/C8H12/c1-2-8-6-4-3-5-7-8/h1,8H,3-7H2
InChI Key:
SSDZYLQUYMOSAK-UHFFFAOYSA-N
SMILES:
C#CC1CCCCC1
EC Number:
213-236-6
Properties
Complexity:
98.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.094g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
108.184g/mol
Monoisotopic Mass:
108.094g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Assembly of an allenylidene ligand, a terminal alkyne, and an acetonitrile molecule: formation of osmacyclopentapyrrole derivatives. Journal of the American Chemical Society 20060329
2- and 8-alkynyl-9-ethyladenines: Synthesis and biological activity at human and rat adenosine receptors. Purinergic signalling 20050601
Properties