83058-95-1
Product Name:
6-Oxabicyclo(3.1.0)hex-3-ene-2-methanol, 2-hydroxy-4-isocyano-alpha-me thyl-, (1-alpha,2-beta,2(R*),5-alpha)-(-)-
Formula:
C8H9NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 167.16 g/mol |
|---|---|
| XLogP3 | -1.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 167.058243149 g/mol |
| Monoisotopic Mass | 167.058243149 g/mol |
| Topological Polar Surface Area | 57.4 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 303 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |