4241-13-8
Product Name:
2-OXO-1,2,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE
Formula:
C10H10N2O
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >26.1 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 174.20 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 174.079312947 g/mol |
| Monoisotopic Mass | 174.079312947 g/mol |
| Topological Polar Surface Area | 52.9 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 368 |
| 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 |