Benzonitrile, 3-[3-(2-benzothiazolylmethoxy)-5-chlorophenoxy]-5-chloro-

Base Information

• Chemical Name: Benzonitrile, 3-[3-(2-benzothiazolylmethoxy)-5-chlorophenoxy]-5-chloro-
• CAS No.: 920035-43-4
• Molecular Formula: C21H12Cl2N2O2S
• Molecular Weight: 427.30300
• DSSTox Substance ID: DTXSID40581444
• Wikidata: Q82472599

Synonyms:920035-43-4;Benzonitrile, 3-[3-(2-benzothiazolylmethoxy)-5-chlorophenoxy]-5-chloro-;SCHEMBL3602049;DTXSID40581444;3-[3-(1,3-benzothiazol-2-ylmethoxy)-5-chloro-phenoxy]-5-chloro-benzonitrile;3-{3-[(1,3-Benzothiazol-2-yl)methoxy]-5-chlorophenoxy}-5-chlorobenzonitrile

Chemical Property of Benzonitrile, 3-[3-(2-benzothiazolylmethoxy)-5-chlorophenoxy]-5-chloro-

Chemical Property:

• Boiling Point: 570.1±50.0 °C(Predicted)
• PSA: 83.38000
• Density: 1.49±0.1 g/cm3(Predicted)
• LogP: 6.84608
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 425.9996542
• Heavy Atom Count: 28
• Complexity: 574

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)COC3=CC(=CC(=C3)Cl)OC4=CC(=CC(=C4)C#N)Cl

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