62498-67-3
Product Name:
1-(4-fluorophenyl)-1,3-dihydro-1-[3-(methylamino)propyl]isobenzofuran-5-carbonitrile
Formula:
C19H19FN2O
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 2441.7 2429.2 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 310.4 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 310.14814140 g/mol |
| Monoisotopic Mass | 310.14814140 g/mol |
| Topological Polar Surface Area | 45 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 440 |
| 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 |
PRODUCT INTRODUCTION
description
Demethylcitalopram is an organic amino compound and a member of benzenes.