861555-68-2
Product Name:
Valeric acid, -delta--chloro--gamma-,-delta--diketo-, -delta--oxime (2CI)
Formula:
C5H6ClNO4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 179.56 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 178.9985354 g/mol |
| Monoisotopic Mass | 178.9985354 g/mol |
| Topological Polar Surface Area | 87 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 201 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |