1427393-40-5
Product Name:
1-CHLORO-7-METHOXYISOQUINOLINE-6-CARBONITRILE(WX130310)
Formula:
C11H7ClN2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 218.64 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 218.0246905 g/mol |
| Monoisotopic Mass | 218.0246905 g/mol |
| Topological Polar Surface Area | 45.9 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 275 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |