209806-89-3
Product Name:
(4S)-5-BROMO-4-(METHOXYMETHOXY)-PENTANE NITRILE
Formula:
C7H12BrNO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 222.08 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 221.00514 g/mol |
| Monoisotopic Mass | 221.00514 g/mol |
| Topological Polar Surface Area | 42.2 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 132 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |