730964-79-1
Product Name:
2-ISOCYANO-4-BENZYLOXYCARBONYLBUTYRIC ACID METHYL ESTER
Formula:
C14H15NO4
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COMPUTED DESCRIPTORS
| Molecular Weight | 261.27 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 8 |
| Exact Mass | 261.10010796 g/mol |
| Monoisotopic Mass | 261.10010796 g/mol |
| Topological Polar Surface Area | 57 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 352 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |