COMPUTED DESCRIPTORS
| Molecular Weight | 85.10 g/mol |
|---|---|
| XLogP3 | -0.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 85.052763847 g/mol |
| Monoisotopic Mass | 85.052763847 g/mol |
| Topological Polar Surface Area | 44 Ų |
| Heavy Atom Count | 6 |
| Formal Charge | 0 |
| Complexity | 61.2 |
| 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
4-hydroxybutylnitrile is a hydroxynitrile that is butanenitrile substituted by a hydroxy group at position 4. It has a role as an Arabidopsis thaliana metabolite. It is a hydroxynitrile and a primary alcohol.