CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colourless to pale yellow liquid; Sweet caramel-like aroma |
|---|---|
| Solubility | Soluble in water |
| Density | 1.082-1.088 (20°) |
| Refractive Index | 1.484-1.490 |
| Kovats Retention Index | 958 966 953 |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral |
| Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 112.13 g/mol |
|---|---|
| XLogP3 | 0.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 112.052429494 g/mol |
| Monoisotopic Mass | 112.052429494 g/mol |
| Topological Polar Surface Area | 33.4 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 72.9 |
| 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
5-Methylfurfuryl alcohol is a natural product found in Nicotiana tabacum with data available.