Methyl 4-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate

Base Information

• Chemical Name: Methyl 4-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate
• CAS No.: 5667-94-7
• Molecular Formula: C16H12ClNO2S2
• Molecular Weight: 349.855
• DSSTox Substance ID: DTXSID90412810
• Wikidata: Q82220429

Synonyms:5667-94-7;methyl 4-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate;DTXSID90412810;AKOS007947190;T5488868;Z18552857

Chemical Property of Methyl 4-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate

Chemical Property:

• Vapor Pressure: 1.35E-10mmHg at 25°C
• Boiling Point: 511.9°Cat760mmHg
• Flash Point: 263.4°C
• Density: 1.43g/cm³
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 348.9997987
• Heavy Atom Count: 22
• Complexity: 390

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC=C(C=C1)CSC2=NC3=C(S2)C=CC(=C3)Cl

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