1-(4-ethoxyphenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea

Base Information

• Chemical Name: 1-(4-ethoxyphenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea
• CAS No.: 6964-84-7
• Molecular Formula: C27H44 N2 O2
• Molecular Weight: 428.6505
• NSC Number: 67039
• DSSTox Substance ID: DTXSID10422956
• Wikidata: Q82235044

Synonyms:NSC67039;6964-84-7;DTXSID10422956;NSC-67039

Chemical Property of 1-(4-ethoxyphenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea

Chemical Property:

• Vapor Pressure: 9.93E-12mmHg at 25°C
• Boiling Point: 540°Cat760mmHg
• Flash Point: 280.4°C
• Density: 0.974g/cm³
• XLogP3: 8.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 18
• Exact Mass: 428.34027865
• Heavy Atom Count: 31
• Complexity: 468

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC=CCC=CCCCCCCCCNC(=O)NC1=CC=C(C=C1)OCC
• Isomeric SMILES: CCCCC/C=C/C/C=C/CCCCCCCCNC(=O)NC1=CC=C(C=C1)OCC

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