CHEMICAL AND PHYSICAL PROPERTIES
| LogP | 4.00 |
|---|---|
| Kovats Retention Index | 1697.8 |
COMPUTED DESCRIPTORS
| Molecular Weight | 191.29 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 191.07687059 g/mol |
| Monoisotopic Mass | 191.07687059 g/mol |
| Topological Polar Surface Area | 44.4 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 167 |
| 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 |
PRODUCT INTRODUCTION
description
1-Isothiocyanato-4-phenylbutane is a member of benzenes and an organic amino compound.