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2,4-Dichloro-6-fluoroquinazoline - 95%, high purity , CAS No.134517-57-0

COA

Grade & Purity:

≥95%

Cas Number: 134517-57-0
Molecular Weight: 217.02
PubChem CID: 16658238
PubChem SID: 504768474

In stock

Item Number

D181242

Grouped product items
SKU	Size	Availability	Price
D181242-250mg	250mg	3	$31.90
D181242-1g	1g	3	$92.90
D181242-5g	5g	2	$288.90

Basic Description

Synonyms	2,4-dichloro-6-fluoroquinazoline \| 134517-57-0 \| MFCD09954884 \| QUINAZOLINE, 2,4-DICHLORO-6-FLUORO- \| 2?4-dichloro-6-fluoroquinazoline \| SCHEMBL1991118 \| DTXSID50586541 \| 6-fluoro-2,4-dichloroquinazoline \| VLPYLGGGYDUVJN-UHFFFAOYSA-N \| AKOS015853535 \| AB55585 \| CS-W001036 \| DS-1
Specifications & Purity	≥95%
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.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazanaphthalenes
    - Subclass Benzodiazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazanaphthalenes
Subclass	Benzodiazines
Intermediate Tree Nodes	Not available
Direct Parent	Quinazolines
Alternative Parents	2-halopyrimidines Benzenoids Aryl fluorides Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Quinazoline - Halopyrimidine - 2-halopyrimidine - Aryl chloride - Aryl fluoride - Aryl halide - Pyrimidine - Benzenoid - Heteroaromatic compound - Azacycle - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
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	504768474
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504768474
IUPAC Name	2,4-dichloro-6-fluoroquinazoline
INCHI	InChI=1S/C8H3Cl2FN2/c9-7-5-3-4(11)1-2-6(5)12-8(10)13-7/h1-3H
InChIKey	VLPYLGGGYDUVJN-UHFFFAOYSA-N
Smiles	C1=CC2=C(C=C1F)C(=NC(=N2)Cl)Cl
Isomeric SMILES	C1=CC2=C(C=C1F)C(=NC(=N2)Cl)Cl
Molecular Weight	217.02
Reaxy-Rn	11069731
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11069731&ln=

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

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Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
K2109203	Certificate of Analysis	Aug 20, 2024	D181242
K2109204	Certificate of Analysis	Aug 20, 2024	D181242
K2109207	Certificate of Analysis	Aug 20, 2024	D181242

Chemical and Physical Properties

Molecular Weight	217.020 g/mol
XLogP3	3.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	215.966 Da
Monoisotopic Mass	215.966 Da
Topological Polar Surface Area	25.800 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	193.000
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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