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6-(trifluoromethyl)furo[2,3-b]pyridin-3-one - 97%, high purity , CAS No.1196155-86-8

COA

Grade & Purity:

≥97%

Cas Number: 1196155-86-8
Molecular Weight: 203.12
PubChem CID: 72212682

In stock

Item Number

F627265

Grouped product items
SKU	Size	Availability	Price
F627265-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$218.90
F627265-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$349.90
F627265-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$583.90
F627265-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,051.90

Basic Description

Synonyms	1196155-86-8 \| 6-(trifluoromethyl)furo[2,3-b]pyridin-3-one \| 6-TRIFLUOROMETHYL-FURO[2,3-B]PYRIDIN-3-ONE \| SCHEMBL21223287 \| MFCD13190282 \| AB70118 \| E73649 \| A936747 \| 6-(TRIFLUOROMETHYL)FURO[2,3-B]PYRIDIN-3(2H)-ONE
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds
      - Level5 Ketones
        Level6 Aryl ketones
        Level7 Aryl alkyl ketones

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Ketones - Aryl ketones
Direct Parent	Aryl alkyl ketones
Alternative Parents	Alkyl aryl ethers Pyridines and derivatives Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Aryl alkyl ketone - Alkyl aryl ether - Pyridine - Heteroaromatic compound - Ether - Organoheterocyclic compound - Azacycle - Oxacycle - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Alkyl fluoride - Alkyl halide - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl 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

IUPAC Name	6-(trifluoromethyl)furo[2,3-b]pyridin-3-one
INCHI	InChI=1S/C8H4F3NO2/c9-8(10,11)6-2-1-4-5(13)3-14-7(4)12-6/h1-2H,3H2
InChIKey	IIHNLSZJYWGRFE-UHFFFAOYSA-N
Smiles	C1C(=O)C2=C(O1)N=C(C=C2)C(F)(F)F
Isomeric SMILES	C1C(=O)C2=C(O1)N=C(C=C2)C(F)(F)F
PubChem CID	72212682
Molecular Weight	203.12

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	203.120 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Exact Mass	203.019 Da
Monoisotopic Mass	203.019 Da
Topological Polar Surface Area	39.200 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	253.000
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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