3-(4-((E)-2-[4-(Didecylamino)phenyl]ethenyl)-1-pyridiniumyl)-1-propanesulfonate

Base Information

• Chemical Name: 3-(4-((E)-2-[4-(Didecylamino)phenyl]ethenyl)-1-pyridiniumyl)-1-propanesulfonate
• CAS No.: 70807-63-5
• Molecular Formula: C36H58 N2 O3 S
• Molecular Weight: 598.92
• Mol file: 70807-63-5.mol

Synonyms:3-(4-(4-N,N-didecylaminostyryl)-1-pyridinium)propylsulfonate;di-10-ASPPS

Chemical Property of 3-(4-((E)-2-[4-(Didecylamino)phenyl]ethenyl)-1-pyridiniumyl)-1-propanesulfonate

Chemical Property:

• PSA: 91.24000
• LogP: 8.91760
• XLogP3: 11.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 24
• Exact Mass: 598.41681489
• Heavy Atom Count: 42
• Complexity: 717

Purity/Quality:

99% ^*data from raw suppliers

3-(4-((E)-2-[4-(DIDECYLAMINO)PHENYL]ETHENYL)-1-PYRIDINIUMYL)-1-PROPANESULFONATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCN(CCCCCCCCCC)C1=CC=C(C=C1)C=CC2=CC=[N+](C=C2)CCCS(=O)(=O)[O-]
• Isomeric SMILES: CCCCCCCCCCN(CCCCCCCCCC)C1=CC=C(C=C1)/C=C/C2=CC=[N+](C=C2)CCCS(=O)(=O)[O-]

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