462066-77-9
Product Name:
2-Chloro-6-[4-(methylsulfanyl)phenyl]nicotinic acid
Formula:
C13H10ClNO2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 279.74 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 279.0120774 g/mol |
| Monoisotopic Mass | 279.0120774 g/mol |
| Topological Polar Surface Area | 75.5 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 295 |
| 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 |