3-(10,10-Dimethyl-9(10H)-anthrylidene)propyl(dimethyl)ammonium methanesulphonate

Base Information

• Chemical Name: 3-(10,10-Dimethyl-9(10H)-anthrylidene)propyl(dimethyl)ammonium methanesulphonate
• CAS No.: 31149-47-0
• Molecular Formula: C22H29NO3S
• Molecular Weight: 387.53556
• European Community (EC) Number: 250-489-1
• DSSTox Substance ID: DTXSID40185082
• Mol file: 31149-47-0.mol

Synonyms:31149-47-0;UNII-HS8YY1BM7I;Melitracen methanesulfonate;EINECS 250-489-1;HS8YY1BM7I;3-(10,10-Dimethyl-9(10H)-anthrylidene)propyl(dimethyl)ammonium methanesulphonate;3-(10,10-DIMETHYL-9(10H)-ANTHRYLIDENE)PROPYL(DIMETHYL)AMMONIUM METHANESULFONATE;C21H25N.CH4O3S;DTXSID40185082;C21-H25-N.C-H4-O3-S

Chemical Property of 3-(10,10-Dimethyl-9(10H)-anthrylidene)propyl(dimethyl)ammonium methanesulphonate

Chemical Property:

• PSA: 65.99000
• LogP: 5.29410
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 387.18681496
• Heavy Atom Count: 27
• Complexity: 457

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C2=CC=CC=C2C(=CCC[NH+](C)C)C3=CC=CC=C31)C.CS(=O)(=O)[O-]

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