N,N-Diethyl-3-methoxy-5,6-dihydro-10H-benzo[c]xanthen-10-iminium perchlorate

Base Information

• Chemical Name: N,N-Diethyl-3-methoxy-5,6-dihydro-10H-benzo[c]xanthen-10-iminium perchlorate
• CAS No.: 111068-14-5
• Molecular Formula: C22 H24 N O2 . Cl O4
• Molecular Weight: 433.88
• DSSTox Substance ID: DTXSID70560742
• Mol file: 111068-14-5.mol

Synonyms:111068-14-5;N,N-Diethyl-3-methoxy-5,6-dihydro-10H-benzo[c]xanthen-10-iminium perchlorate;diethyl-(3-methoxy-5,6-dihydrobenzo[c]xanthen-10-ylidene)azanium;perchlorate;10-Diethylamino-3-methoxy-6,12a-dihydro-5H-benzo[c]xanthylium perchlorate;DTXSID70560742;AKOS024389632

Chemical Property of N,N-Diethyl-3-methoxy-5,6-dihydro-10H-benzo[c]xanthen-10-iminium perchlorate

Chemical Property:

• PSA: 99.88000
• LogP: 5.54860
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 433.1292152
• Heavy Atom Count: 30
• Complexity: 797

Purity/Quality:

98%min ^*data from raw suppliers

10-DIETHYLAMINO-3-METHOXY-6,12A-DIHYDRO-5H-BENZO[C]XANTHYLIUM PERCHLORATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC[N+](=C1C=CC2=CC3=C(C4=C(CC3)C=C(C=C4)OC)OC2=C1)CC.[O-]Cl(=O)(=O)=O