175277-41-5
Product Name:
6-(1,1-DIMETHOXYETHYL)-2-MERCAPTONICOTINONITRILE
Formula:
C10H12N2O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 224.28 g/mol |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 224.06194880 g/mol |
| Monoisotopic Mass | 224.06194880 g/mol |
| Topological Polar Surface Area | 86.4 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 386 |
| 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 |