Benzoic acid, 4-heptyl-, 4-[(4-cyanophenoxy)carbonyl]phenyl ester

Base Information

• Chemical Name: Benzoic acid, 4-heptyl-, 4-[(4-cyanophenoxy)carbonyl]phenyl ester
• CAS No.: 55453-42-4
• Molecular Formula: C28H27NO4
• DSSTox Substance ID: DTXSID10364827
• Wikidata: Q82148996

Synonyms:55453-42-4;[4-(4-cyanophenoxy)carbonylphenyl] 4-heptylbenzoate;Benzoic acid, 4-heptyl-, 4-[(4-cyanophenoxy)carbonyl]phenyl ester;C28H27NO4;DTXSID10364827;SR-01000388888;4-[(4-cyanophenoxy)carbonyl]phenyl 4-heptylbenzoate;SR-01000388888-1

Chemical Property of Benzoic acid, 4-heptyl-, 4-[(4-cyanophenoxy)carbonyl]phenyl ester

Chemical Property:

• XLogP3: 8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 12
• Exact Mass: 441.19400834
• Heavy Atom Count: 33
• Complexity: 644

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N

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