N-[4-[Bis[3-(carboxymethyl)-4-methoxyphenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium

Base Information

• Chemical Name: N-[4-[Bis[3-(carboxymethyl)-4-methoxyphenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium
• CAS No.: 69060-00-0
• Molecular Formula: C27H28 N O6
• Molecular Weight: 480.55278
• Nikkaji Number: J332.799J
• Mol file: 69060-00-0.mol

Synonyms:C27H28NO6;C27-H28-N-O6;N-[4-[Bis[3-(carboxymethyl)-4-methoxyphenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium

Chemical Property of N-[4-[Bis[3-(carboxymethyl)-4-methoxyphenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium

Chemical Property:

• PSA: 98.90000
• LogP: 2.26430
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 462.19166261
• Heavy Atom Count: 34
• Complexity: 820

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+](=C1C=CC(=C(C2=CC(=C(C=C2)OC)CC(=O)O)C3=CC(=C(C=C3)OC)CC(=O)O)C=C1)C

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