54443-97-9
Product Name:
3-(2-METHYL-1,3-BENZOXAZOL-3-IUM-3-YL)-1-PROPANESULFONATE
Formula:
C11H13NO4S
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COMPUTED DESCRIPTORS
Molecular Weight | 255.29 g/mol |
---|---|
XLogP3 | 1.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 255.05652907 g/mol |
Monoisotopic Mass | 255.05652907 g/mol |
Topological Polar Surface Area | 82.6 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 338 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |