O-(1,3-benzothiazol-2-yl) 2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoethanethioate

Base Information

• Chemical Name: O-(1,3-benzothiazol-2-yl) 2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoethanethioate
• CAS No.: 84994-24-1
• Molecular Formula: C13H10 N4 O3 S2
• Molecular Weight: 350.44
• European Community (EC) Number: 686-235-5
• Mol file: 84994-24-1.mol

Synonyms:84994-24-1;FT-0641988;(Z)-O-benzo[d]thiazol-2-yl 2-(2-aminothiazol-4-yl)-2-(methoxyimino)ethanethioate

Chemical Property of O-(1,3-benzothiazol-2-yl) 2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoethanethioate

Chemical Property:

• Vapor Pressure: 1.04E-12mmHg at 25°C
• Boiling Point: 563.2°C at 760 mmHg
• PKA: 1.30±0.10(Predicted)
• Flash Point: 294.4°C
• PSA: 171.19000
• Density: 1.63g/cm³
• LogP: 3.67310
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 349.99658910
• Heavy Atom Count: 22
• Complexity: 451

Purity/Quality:

99% ^*data from raw suppliers

BENZOTHIAZOL-2-YL-2-(2-AMINOTHIAZOLE-4-YL)-(Z)-2-METHOXYIMINO THIOACETATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R36/37/38:
• Hazard Codes: Xi:Irritant
• Statements: R36/37/38:
• Safety Statements: S26:; S37/39:

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CON=C(C1=CSC(=N1)N)C(=S)OC2=NC3=CC=CC=C3S2