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6-Chloro-1-hexyne - >97.0%(GC), high purity , CAS No.10297-06-0

COA

Grade & Purity:

≥97%(GC)

Cas Number: 10297-06-0
Molecular Weight: 116.59
Beilstein Registry Number: 1(4)1008
MDL number: MFCD00013697
PubChem CID: 272001
PubChem SID: 488189192

In stock

Item Number

C154119

Grouped product items
SKU	Size	Availability	Price
C154119-1ml	1ml	5	$10.90
C154119-5ml	5ml	4	$41.90
C154119-25ml	25ml	2	$188.90

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Conjugation chemistry (47) Non heterocyclic block (8163)

Basic Description

Synonyms	1-chloro-5-hexyne \| 6-Chloro-1-hexyne \| ZUKOCGMVJUXIJA-UHFFFAOYSA- \| 5-Hexynechloride \| 6-chloro-hex-1-yne \| 6-chlorohex-1-yne \| EN300-95983 \| 5-Hexynyl Chloride \| AKOS009156863 \| DTXSID00297453 \| InChI=1/C6H9Cl/c1-2-3-4-5-6-7/h1H,3-6H2 \| SY011191 \| MFCD0
Specifications & Purity	≥97%(GC)
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	6-Chloro-1-hexyne is a halogenated hydrocarbon. It shows high reactivity in milling process during the synthesis of chloroalkyl-functionalized silicon nanoparticles due to the presence of triple bond. 6-Chloro-1-hexyne was used in the preparation of novel bis(indolyl)maleimide pyridinophanes and disubstituted polyacetylenes bearing naphthalene pendants with varying spacer lengths. It may be used in the preparation of diethyl 6-chloro-1-hexynylphosphonate, by lithiation with n-BuLi followed by the reaction with diethyl chlorophosphate.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Acetylides

Kingdom	Organic compounds
Superclass	Acetylides
Class	Not available
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Acetylides
Alternative Parents	Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Acetylide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as acetylides. These are compounds arising by replacement of one or both hydrogen atoms of acetylene (ethyne) by a metal or other cationic group. E.g. NaC#CH monosodium acetylide. By extension, analogous compounds derived from terminal acetylenes, RC#CH. The class is limited here to derivatives of acetylene where the hydrogen atom is replaced with an element with similar or lower electronegativity that carbon.
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

Names and Identifiers

Pubchem Sid	488189192
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488189192
IUPAC Name	6-chlorohex-1-yne
INCHI	InChI=1S/C6H9Cl/c1-2-3-4-5-6-7/h1H,3-6H2
InChIKey	ZUKOCGMVJUXIJA-UHFFFAOYSA-N
Smiles	C#CCCCCCl
Isomeric SMILES	C#CCCCCCl
WGK Germany	3
Molecular Weight	116.59
Beilstein	1(4)1008
Reaxy-Rn	1739919
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1739919&ln=

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
C23151276	Certificate of Analysis	Feb 24, 2023	C154119
C23151277	Certificate of Analysis	Feb 24, 2023	C154119
C23151601	Certificate of Analysis	Feb 24, 2023	C154119
C23151275	Certificate of Analysis	Feb 24, 2023	C154119
C23151274	Certificate of Analysis	Feb 24, 2023	C154119

Chemical and Physical Properties

Sensitivity	Air & Heat Sensitive
Refractive Index	1.45
Flash Point(°F)	99°F
Flash Point(°C)	37℃
Boil Point(°C)	83℃/95mm
Molecular Weight	116.590 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	3
Exact Mass	116.039 Da
Monoisotopic Mass	116.039 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	67.500
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

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