[2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate

Base Information

• Chemical Name: [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate
• CAS No.: 6077-54-9
• Molecular Formula: C22H25NO4S
• Molecular Weight: 399.5032
• DSSTox Substance ID: DTXSID10387258
• Wikidata: Q82181312

Synonyms:6077-54-9;CBMicro_044777;Oprea1_205376;DTXSID10387258;STK761038;[2-methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate;AKOS001727025;BIM-0044542.P001;EU-0085518;SR-01000526024;SR-01000526024-1;2-methoxy-4-[(4-methylpiperidin-1-yl)carbonothioyl]phenyl 4-methoxybenzoate;2-methoxy-4-[(4-methylpiperidino)carbothioyl]phenyl 4-methoxybenzoate

Chemical Property of [2-Methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate

Chemical Property:

• Vapor Pressure: 6.21E-13mmHg at 25°C
• Boiling Point: 568.4°C at 760 mmHg
• Flash Point: 297.5°C
• Density: 1.196g/cm³
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 399.15042945
• Heavy Atom Count: 28
• Complexity: 527

Purity/Quality:

Safty Information:

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Useful:

• Canonical SMILES: CC1CCN(CC1)C(=S)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)OC)OC

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