118420-00-1
Product Name:
2-PROPENOIC ACID, 3-(6-CHLORO-3-PYRIDINYL)-, (E)-
Formula:
C8H6ClNO2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 183.59 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 183.0087061 g/mol |
| Monoisotopic Mass | 183.0087061 g/mol |
| Topological Polar Surface Area | 50.2 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 194 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |