Skip to the beginning of the images gallery

1,3-Dichloro-6-fluoroisoquinoline - 97%, high purity , CAS No.1041423-26-0

COA

Grade & Purity:

≥97%

Cas Number: 1041423-26-0
Molecular Weight: 216.04
PubChem CID: 46839960
PubChem SID: 488201376

In stock

Item Number

D165604

Grouped product items
SKU	Size	Availability	Price
D165604-250mg	250mg	4	$48.90
D165604-1g	1g	4	$150.90
D165604-5g	5g	2	$675.90
D165604-10g	10g	1	$1,215.90

Discover 1,3-Dichloro-6-fluoroisoquinoline by Aladdin Scientific in 97% for only $48.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	1041423-26-0 \| 1,3-Dichloro-6-fluoroisoquinoline \| 1,3-dichloro-6-fluoro-isoquinoline \| BDAYBRFYRZTMGQ-UHFFFAOYSA-N \| 1,3-Dichloro-6-fluoroisoquinoline, 97% \| SB13565 \| FT-0717615 \| DS-10126 \| SCHEMBL8167379 \| AKOS015851284 \| J-001114 \| EN300-263448 \| MFC
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Isoquinolines and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Isoquinolines and derivatives
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Isoquinolines and derivatives
Alternative Parents	Polyhalopyridines 2-halopyridines Benzenoids Aryl fluorides Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Isoquinoline - Polyhalopyridine - 2-halopyridine - Aryl chloride - Aryl fluoride - Aryl halide - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organochloride - Organohalogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organofluoride - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
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	488201376
IUPAC Name	1,3-dichloro-6-fluoroisoquinoline
INCHI	InChI=1S/C9H4Cl2FN/c10-8-4-5-3-6(12)1-2-7(5)9(11)13-8/h1-4H
InChIKey	BDAYBRFYRZTMGQ-UHFFFAOYSA-N
Smiles	C1=CC2=C(N=C(C=C2C=C1F)Cl)Cl
Isomeric SMILES	C1=CC2=C(N=C(C=C2C=C1F)Cl)Cl
WGK Germany	3
UN Number	2811
Packing Group	III
Molecular Weight	216.04
Reaxy-Rn	15432600
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15432600&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.

10 results found

Lot Number	Certificate Type	Date	Item
K2109194	Certificate of Analysis	Aug 20, 2024	D165604
K2109195	Certificate of Analysis	Aug 20, 2024	D165604
K2217684	Certificate of Analysis	Oct 10, 2022	D165604
K2217640	Certificate of Analysis	Oct 10, 2022	D165604
K2217639	Certificate of Analysis	Oct 10, 2022	D165604
K2217765	Certificate of Analysis	Oct 10, 2022	D165604
K2217726	Certificate of Analysis	Oct 10, 2022	D165604
K2217689	Certificate of Analysis	Oct 10, 2022	D165604
K2217643	Certificate of Analysis	Oct 10, 2022	D165604
K2217858	Certificate of Analysis	Oct 10, 2022	D165604

Chemical and Physical Properties

Melt Point(°C)	131-133℃
Molecular Weight	216.040 g/mol
XLogP3	4.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	214.97 Da
Monoisotopic Mass	214.97 Da
Topological Polar Surface Area	12.900 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	190.000
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

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration