C12-H14-N2-O3.C10-H16-O4-S

Base Information

• Chemical Name: C12-H14-N2-O3.C10-H16-O4-S
• CAS No.: 63768-21-8
• Molecular Formula: C22H30N2O7S
• Molecular Weight: 466.5478
• DSSTox Substance ID: DTXSID70980345

Synonyms:C12-H14-N2-O3.C10-H16-O4-S;DTXSID70980345;(7,7-Dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid--3-(2,3-dihydroxypropyl)-2-methylquinazolin-4(3H)-one (1/1)

Chemical Property of C12-H14-N2-O3.C10-H16-O4-S

Chemical Property:

• Vapor Pressure: 5.79E-10mmHg at 25°C
• Boiling Point: 478.5°C at 760 mmHg
• Flash Point: 243.2°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 466.17737247
• Heavy Atom Count: 32
• Complexity: 733

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC2=CC=CC=C2C(=O)N1CC(CO)O.CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C
• Isomeric SMILES: CC1=NC2=CC=CC=C2C(=O)N1CC(CO)O.CC1(C2CC[C@]1(C(=O)C2)CS(=O)(=O)O)C

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