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Hexafluoroglutaryl fluoride , CAS No.678-78-4

COA

Cas Number: 678-78-4
Molecular Weight: 244.04
PubChem CID: 69622

In stock

Item Number

H331066

Grouped product items
SKU	Size	Availability	Price	Qty
H331066-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,408.90

Basic Description

Synonyms	FT-0626999 \| 2,2,3,3,4,4-hexafluoropentanedioyl difluoride \| Pentanedioyl difluoride, 2,2,3,3,4,4-hexafluoro- \| Pentanedioyl difluoride, hexafluoro- \| Perfluoroglutaryl fluoride \| SCHEMBL4184561 \| AKOS015852705 \| DTXSID50218052 \| A835918 \| MFCD00054652 \|
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 Organohalogen compounds
  - Class Acyl halides
    - Subclass Acyl fluorides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Acyl halides
Subclass	Acyl fluorides
Intermediate Tree Nodes	Not available
Direct Parent	Acyl fluorides
Alternative Parents	Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Acyl fluoride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Carbonyl group - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as acyl fluorides. These are organic compounds containing the functional group -CO-F.
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

IUPAC Name	2,2,3,3,4,4-hexafluoropentanedioyl difluoride
INCHI	InChI=1S/C5F8O2/c6-1(14)3(8,9)5(12,13)4(10,11)2(7)15
InChIKey	XAKMJUAGVWKMOB-UHFFFAOYSA-N
Smiles	C(=O)(C(C(C(C(=O)F)(F)F)(F)F)(F)F)F
Isomeric SMILES	C(=O)(C(C(C(C(=O)F)(F)F)(F)F)(F)F)F
Molecular Weight	244.04
Reaxy-Rn	1914560
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1914560&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Boil Point(°C)	46-47° C
Molecular Weight	244.040 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	4
Exact Mass	243.977 Da
Monoisotopic Mass	243.977 Da
Topological Polar Surface Area	34.100 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	267.000
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

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