3-(p-(alpha-(p-Methoxyphenyl)beta-nitrostyryl)phenoxy)-N,N-dimethylpropylamine monocitrate

Base Information

• Chemical Name: 3-(p-(alpha-(p-Methoxyphenyl)beta-nitrostyryl)phenoxy)-N,N-dimethylpropylamine monocitrate
• CAS No.: 56287-31-1
• Molecular Formula: C32H36N2O11
• Molecular Weight: 624.63504
• UNII: 0CV2CZ4K5D
• Mol file: 56287-31-1.mol

Synonyms:3-(p-(alpha-(p-methoxyphenyl)beta-nitrostyryl)phenoxy)-N,N-dimethylpropylamine monocitrate;CI 680;CI-680

Chemical Property of 3-(p-(alpha-(p-Methoxyphenyl)beta-nitrostyryl)phenoxy)-N,N-dimethylpropylamine monocitrate

Chemical Property:

• Vapor Pressure: 3.45E-12mmHg at 25°C
• Boiling Point: 551°C at 760 mmHg
• Flash Point: 287°C
• PSA: 199.65000
• LogP: 4.49370
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 14
• Exact Mass: 624.23190997
• Heavy Atom Count: 45
• Complexity: 821

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
• Isomeric SMILES: CN(C)CCCOC1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\[N+](=O)[O-])/C3=CC=C(C=C3)OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

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