(2-Hydroxy-1-methyl-2,3-diphenylpropyl)ammonium (1S)-2-oxobornane-10-sulphonate

Base Information

• Chemical Name: (2-Hydroxy-1-methyl-2,3-diphenylpropyl)ammonium (1S)-2-oxobornane-10-sulphonate
• CAS No.: 61791-79-5
• Molecular Formula: C26H35NO5S
• Molecular Weight: 473.6248
• European Community (EC) Number: 263-204-0
• DSSTox Substance ID: DTXSID40977363

Synonyms:EINECS 263-204-0;61791-79-5;(2-Hydroxy-1-methyl-2,3-diphenylpropyl)ammonium (1S)-2-oxobornane-10-sulphonate;DTXSID40977363;(7,7-Dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid--3-amino-1,2-diphenylbutan-2-ol (1/1)

Chemical Property of (2-Hydroxy-1-methyl-2,3-diphenylpropyl)ammonium (1S)-2-oxobornane-10-sulphonate

Chemical Property:

• Vapor Pressure: 3.34E-07mmHg at 25°C
• Boiling Point: 402.6°C at 760 mmHg
• Flash Point: 197.3°C
• PSA: 130.52000
• LogP: 3.75510
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 473.22359439
• Heavy Atom Count: 33
• Complexity: 647

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC(C(CC1=CC=CC=C1)(C2=CC=CC=C2)O)N.CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C
• Isomeric SMILES: C[C@@H](C(CC1=CC=CC=C1)(C2=CC=CC=C2)O)N.CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C

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