412311-47-8
Product Name:
Oxiranecarbonitrile, 2-formyl-3,3-dimethyl- (9CI)
Formula:
C6H7NO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 125.13 g/mol |
|---|---|
| XLogP3 | -0.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 125.047678466 g/mol |
| Monoisotopic Mass | 125.047678466 g/mol |
| Topological Polar Surface Area | 53.4 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 200 |
| 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 |