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4,6-Difluorobenzo[c][1,2,5]thiadiazole - 95%, high purity , CAS No.1221793-59-4

COA

Grade & Purity:

≥95%

Cas Number: 1221793-59-4
Molecular Weight: 172.2
PubChem CID: 53216865

In stock

Item Number

D180415

Grouped product items
SKU	Size	Availability	Price	Qty
D180415-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,172.90
D180415-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,943.90

Discover 4,6-Difluorobenzo[c][1,2,5]thiadiazole by Aladdin Scientific in 95% for only $1,172.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4,6-Difluorobenzo[c][1,2,5]thiadiazole \| 1221793-59-4 \| 4,6-difluoro-2,1,3-benzothiadiazole \| DTXSID20681996 \| MFCD16036121 \| AKOS006333905 \| BS-23197 \| CS-0211533 \| A891193
Specifications & Purity	≥95%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzothiadiazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzothiadiazoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzothiadiazoles
Alternative Parents	Benzenoids Aryl fluorides Thiadiazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	2,1,3-benzothiadiazole - Benzenoid - Aryl halide - Aryl fluoride - Heteroaromatic compound - Thiadiazole - Azole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzothiadiazoles. These are heterocyclic aromatic compounds containing a benzene ring fused to a thiadiazole ring. Thiadiazole is a five-membered aromatic heterocycle made up of one sulfur atom and two nitrogen atoms.
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	4,6-difluoro-2,1,3-benzothiadiazole
INCHI	InChI=1S/C6H2F2N2S/c7-3-1-4(8)6-5(2-3)9-11-10-6/h1-2H
InChIKey	GEGUVPYPLOQEHL-UHFFFAOYSA-N
Smiles	C1=C(C=C(C2=NSN=C21)F)F
Isomeric SMILES	C1=C(C=C(C2=NSN=C21)F)F
Molecular Weight	172.2
Reaxy-Rn	33874592
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=33874592&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	172.160 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	171.991 Da
Monoisotopic Mass	171.991 Da
Topological Polar Surface Area	54.000 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	158.000
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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