3-[(4-chlorophenoxy)methyl]-1,3-benzothiazol-2(3H)-one

Base Information

• Chemical Name: 3-[(4-chlorophenoxy)methyl]-1,3-benzothiazol-2(3H)-one
• CAS No.: 5354-54-1
• Molecular Formula: C₂₁H₃₃N₃O
• Molecular Weight: 343.513
• DSSTox Substance ID: DTXSID80968295
• Wikidata: Q82951054
• ChEMBL ID: CHEMBL1430116

Synonyms:3-[(4-chlorophenoxy)methyl]-1,3-benzothiazol-2(3H)-one;SMR000137407;MLS000532456;5354-54-1;3-[(4-chlorophenoxy)methyl]-1,3-benzothiazol-2-one;cid_779738;CHEMBL1430116;BDBM39685;DTXSID80968295;HMS2166O12;HMS3320I03;AB00082528-01;3-[(4-chloranylphenoxy)methyl]-1,3-benzothiazol-2-one

Chemical Property of 3-[(4-chlorophenoxy)methyl]-1,3-benzothiazol-2(3H)-one

Chemical Property:

• Vapor Pressure: 5.87E-09mmHg at 25°C
• Boiling Point: 468.7°Cat760mmHg
• Flash Point: 237.2°C
• Density: 1.409g/cm³
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 291.0120774
• Heavy Atom Count: 19
• Complexity: 333

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N(C(=O)S2)COC3=CC=C(C=C3)Cl

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