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1-Ethynyl-1-cyclohexene（with stabilized BHT） - >98.0%(GC), high purity , CAS No.931-49-7

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1-Ethynyl-1-cyclohexene（with stabilized BHT） - >98.0%(GC), high purity , CAS No.931-49-7

1 Citations

COA

Grade & Purity:

≥98%(GC)

Cas Number: 931-49-7
Molecular Weight: 106.17
MDL number: MFCD00001568
PubChem CID: 79128
PubChem SID: 504755348

In stock

Item Number

E156239

Grouped product items
SKU	Size	Availability	Price	Qty
E156239-1ml	1ml	2	$29.90
E156239-5ml	5ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$121.90

View related series

Conjugation chemistry (47) Non heterocyclic block (8163)

Basic Description

Synonyms	1-Ethynylcyclohexene, 99% \| 7TJ42SRP2Z \| ethynylcyclohexene \| MFCD00001568 \| DTXSID5073244 \| Cyclohexene, 1-ethynyl- \| CYCLOHEX-1-ENYLACETYLENE \| cyclohexenylacetylene \| InChI=1/C8H10/c1-2-8-6-4-3-5-7-8/h1,6H,3-5,7H \| SY045891 \| F14623 \| 1-ethynyl-1-cyclo
Specifications & Purity	≥98%(GC)
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Hydrocarbons
  - Class Unsaturated hydrocarbons
    - Subclass Branched unsaturated hydrocarbons

Kingdom	Organic compounds
Superclass	Hydrocarbons
Class	Unsaturated hydrocarbons
Subclass	Branched unsaturated hydrocarbons
Intermediate Tree Nodes	Not available
Direct Parent	Branched unsaturated hydrocarbons
Alternative Parents	Enynes Cycloalkenes Acetylides Unsaturated aliphatic hydrocarbons Acetylenes
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Branched unsaturated hydrocarbon - Enyne - Acetylide - Cycloalkene - Cyclic olefin - Unsaturated aliphatic hydrocarbon - Olefin - Acetylene - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as branched unsaturated hydrocarbons. These are hydrocarbons that contains one or more unsaturated carbon atoms, and an aliphatic branch.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504755348
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504755348
IUPAC Name	1-ethynylcyclohexene
INCHI	InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h1,6H,3-5,7H2
InChIKey	DKFHWNGVMWFBJE-UHFFFAOYSA-N
Smiles	C#CC1=CCCCC1
Isomeric SMILES	C#CC1=CCCCC1
WGK Germany	3
UN Number	3295
Packing Group	III
Molecular Weight	106.17
Reaxy-Rn	1421318
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1421318&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number	Certificate Type	Date	Item
I2016337	Certificate of Analysis	Jul 15, 2024	E156239
H2210003	Certificate of Analysis	Jul 29, 2022	E156239
H2209325	Certificate of Analysis	Jul 29, 2022	E156239

Chemical and Physical Properties

Sensitivity	heat sensitive
Refractive Index	1.5
Flash Point(°F)	84.2 °F
Flash Point(°C)	29 °C
Boil Point(°C)	151 °C
Molecular Weight	106.160 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	106.078 Da
Monoisotopic Mass	106.078 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	143.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Lingqi Huang, Kecheng Hu, Ganggang Ye, Zhibin Ye. (2021) Highly selective semi-hydrogenation of alkynes with a Pd nanocatalyst modified with sulfide-based solid-phase ligands. Molecular Catalysis, 506 (111535).

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