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1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate - 97%, high purity , CAS No.156241-41-7

COA

Grade & Purity:

≥97%

Cas Number: 156241-41-7
Molecular Weight: 300.09
MDL number: MFCD02093340
PubChem CID: 2775011
PubChem SID: 488193618

In stock

Item Number

H157173

Grouped product items
SKU	Size	Availability	Price
H157173-1g	1g	2	$152.90
H157173-5g	5g	3	$587.90
H157173-25g	25g	2	$2,641.90

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Element classified compounds (2014) Non heterocyclic fluorine-containing block (1408)

Basic Description

Synonyms	Trifluoromethanesulfonic Acid 1,1,1,3,3,3-Hexafluoroisopropyl Ester \| NRHQWNHARTXNOE-UHFFFAOYSA-N \| 2H-Perfluoroprop-2-yl trifluoromethanesulphonate \| A809726 \| T71855 \| STL557358 \| 1,1,1,3,3,3-Hexafluoroisopropyl Triflate \| HEXAFLUOROISOPROPYLTRIFLUOROME
Specifications & Purity	≥97%
Storage Temp	Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Organic sulfonic acids and derivatives
    - Subclass Organosulfonic acids and derivatives
      - Level5 Alkanesulfonic acids and derivatives
        Level6 Alkanesulfonic acids
        Level7 Trifluoromethanesulfonates

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Organic sulfonic acids and derivatives
Subclass	Organosulfonic acids and derivatives
Intermediate Tree Nodes	Alkanesulfonic acids and derivatives - Alkanesulfonic acids
Direct Parent	Trifluoromethanesulfonates
Alternative Parents	Sulfonic acid esters Organosulfonic acid esters Sulfonyls Methanesulfonates Trihalomethanes Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Trifluoromethanesulfonate - Sulfonic acid ester - Organosulfonic acid ester - Methanesulfonate - Sulfonyl - Trihalomethane - Alkyl fluoride - Hydrocarbon derivative - Halomethane - Organic oxide - Organosulfur compound - Organooxygen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Alkyl halide - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as trifluoromethanesulfonates. These are alkanesulfonic acids, that contain a sulfonate group that is substituted with a trifluoromethyl group.
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	488193618
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488193618
IUPAC Name	1,1,1,3,3,3-hexafluoropropan-2-yl trifluoromethanesulfonate
INCHI	InChI=1S/C4HF9O3S/c5-2(6,7)1(3(8,9)10)16-17(14,15)4(11,12)13/h1H
InChIKey	NRHQWNHARTXNOE-UHFFFAOYSA-N
Smiles	C(C(F)(F)F)(C(F)(F)F)OS(=O)(=O)C(F)(F)F
Isomeric SMILES	C(C(F)(F)F)(C(F)(F)F)OS(=O)(=O)C(F)(F)F
Molecular Weight	300.09
Reaxy-Rn	5064178
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5064178&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.

5 results found

Lot Number	Certificate Type	Date	Item
C2310260	Certificate of Analysis	Dec 16, 2022	H157173
G2321019	Certificate of Analysis	Dec 16, 2022	H157173
C2310279	Certificate of Analysis	Dec 16, 2022	H157173
C2310312	Certificate of Analysis	Dec 16, 2022	H157173
I2412051	Certificate of Analysis	Dec 16, 2022	H157173

Chemical and Physical Properties

Sensitivity	Moisture Sensitive
Molecular Weight	300.100 g/mol
XLogP3	3.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	2
Exact Mass	299.95 Da
Monoisotopic Mass	299.95 Da
Topological Polar Surface Area	51.800 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	340.000
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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