302918-03-2
Product Name:
[4-(3-nitrophenyl)-1,3-thiazol-2-yl]acetonitrile
Formula:
C11H7N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 245.26 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 245.02589765 g/mol |
| Monoisotopic Mass | 245.02589765 g/mol |
| Topological Polar Surface Area | 111 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 335 |
| 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 |