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The chemical compound "1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(4-chloro-2-fluorophenyl)hexahydro-3-thioxo-" is a complex heterocyclic molecule with a unique structure. It features a triazolo[1,2-a]pyridazine core, which is a fused ring system consisting of a triazole and a pyridazine. The compound is further characterized by the presence of a 4-chloro-2-fluorophenyl group attached to the 2-position of the core, a hexahydro (six-carbon) chain, and a 3-thioxo (thiocarbonyl) group. This molecule is likely to be of interest in medicinal chemistry due to its potential as a precursor or intermediate in the synthesis of biologically active compounds, given its diverse functional groups and structural complexity.

68017-44-7

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68017-44-7 Usage

Chemical class

Pyridine derivatives

Explanation

The compound belongs to a class of organic compounds that contain a pyridine ring.

Explanation

The molecular formula represents the total number of each type of atom present in the molecule.

Explanation

The molecular weight is the sum of the atomic weights of all the atoms in the molecule.

Explanation

The solubility of the compound in various solvents is not provided in the material.

Explanation

The stability of the compound under different conditions is not provided in the material.

Explanation

The reactivity of the compound with other chemicals or under different conditions is not provided in the material.

Explanation

The toxicity of the compound is not provided in the material, and further research would be needed to determine its safety.

Triazolo ring

A six-membered heterocyclic ring with three nitrogen atoms.

Thioxo group

A sulfur-oxygen double bond (C=S) present in the molecule.

Six-membered heterocyclic ring

The presence of a six-membered ring in the compound's structure.

Chloro

A chlorine atom (-Cl) attached to the phenyl group.

Fluoro

A fluorine atom (-F) attached to the phenyl group.

Biological activity

The compound may have potential biological activity, making it a candidate for further research.

Medicinal and pharmaceutical research

It could be used in the development of new drugs.

Industrial applications

The compound may have uses in the synthesis of other organic compounds.

Molecular weight

Approximately 355.8 g/mol

Solubility

Unknown

Stability

Unknown

Reactivity

Unknown

Toxicity

Unknown

Check Digit Verification of cas no

The CAS Registry Mumber 68017-44-7 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 6,8,0,1 and 7 respectively; the second part has 2 digits, 4 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 68017-44:
(7*6)+(6*8)+(5*0)+(4*1)+(3*7)+(2*4)+(1*4)=127
127 % 10 = 7
So 68017-44-7 is a valid CAS Registry Number.
InChI:InChI=1/C12H11ClFN3OS/c13-8-3-4-10(9(14)7-8)17-11(18)15-5-1-2-6-16(15)12(17)19/h3-4,7H,1-2,5-6H2

68017-44-7SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(4-chloro-2-fluorophenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazin-1-one

1.2 Other means of identification

Product number -
Other names -

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:68017-44-7 SDS

68017-44-7Upstream product

68017-44-7Downstream Products

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