(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3-methoxyphenyl)prop-2-enenitrile

Base Information

• Chemical Name: (E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3-methoxyphenyl)prop-2-enenitrile
• CAS No.: 5346-87-2
• Molecular Formula: C19H13ClN2OS
• Molecular Weight: 352.8373
• DSSTox Substance ID: DTXSID80416382
• Wikidata: Q82225643

Synonyms:5346-87-2;(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3-methoxyphenyl)prop-2-enenitrile;ZINC04010618;DTXSID80416382;AKOS001097142

Chemical Property of (E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3-methoxyphenyl)prop-2-enenitrile

Chemical Property:

• Vapor Pressure: 7.06E-12mmHg at 25°C
• Boiling Point: 543.6°Cat760mmHg
• Flash Point: 282.6°C
• Density: 1.307g/cm³
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 352.0437119
• Heavy Atom Count: 24
• Complexity: 495

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Cl
• Isomeric SMILES: COC1=CC=CC(=C1)/C=C(\C#N)/C2=NC(=CS2)C3=CC=C(C=C3)Cl

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