105892-20-4
Product Name:
((2,4-Dinitrophenyl)thio)acetic acid 2-aminoethanol (1:1)
Formula:
C8H6N2O6S.C2H7NO
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COMPUTED DESCRIPTORS
| Molecular Weight | 319.29 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 319.04742094 g/mol |
| Monoisotopic Mass | 319.04742094 g/mol |
| Topological Polar Surface Area | 201 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 335 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |