25855-27-0
Product Name:
1-ALLYL-2,4-DIOXO-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBONITRILE
Formula:
C8H7N3O2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 177.16 g/mol |
|---|---|
| XLogP3 | -0.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 177.053826475 g/mol |
| Monoisotopic Mass | 177.053826475 g/mol |
| Topological Polar Surface Area | 73.2 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 348 |
| 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 |