219986-75-1
Product Name:
2-(8-BROMO-2,3,6,7-TETRAHYDRO-BENZO[1,2-B:4,5-B']DIFURAN-4-YL)-1-METHYL-ETHYLAMINE
Formula:
C13H16BrNO2
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 2168 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 298.18 g/mol |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 297.03644 g/mol |
| Monoisotopic Mass | 297.03644 g/mol |
| Topological Polar Surface Area | 44.5 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 289 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |