Name: Name:(5E)-5-(2-Chloro-6-fluorobenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one
Brand: AABLOCKS
SKU: AA00BERC
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00BERC

Chemical Name: (5E)-5-(2-Chloro-6-fluorobenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one

CAS Number: 217316-44-4

Molecular Formula: C10H5ClFNOS2

Molecular Weight: 273.7342

MDL Number: MFCD04969005

SMILES: SC1=NC(=O)/C(=C\c2c(F)cccc2Cl)/S1

Properties

Storage: Keep in dry area;2-8℃;

Complexity: 361

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 1

Formal Charge: 0

Heavy Atom Count: 16

Hydrogen Bond Acceptor Count: 4

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 3.5

Downstream Synthesis Route

141-84-4

387-45-1

217316-44-4

[1]Akunuri,Ravikumar;Unnissa,Tanveer;Kaul,Grace;Akhir,Abdul;Saxena,Deepanshi;Wajidali,Mohmadd;Veerareddy,Vaishnavi;Yaddanapudi,VenkataMadhavi;Chopra,Sidharth;Nanduri,Srinivas[Chemistryandbiodiversity,2022,vol.19,#7]

[2]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2013/15456,2013,A1Locationinpatent:Page/Pagecolumn38

217316-44-4 | (5E)-5-(2-Chloro-6-fluorobenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one