CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Dark yellow powder; [Sigma-Aldrich MSDS] |
|---|---|
| Collision Cross Section | 159.9 Ų [M*]+ 162.6 Ų [M+H]+ |
| Kovats Retention Index | 3497 3498 3498 3456 3498 3465.3 593.5 573.8 |
| Chemical Classes | Other Classes -> Polycyclic Aromatic Hydrocarbons |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Health Hazard GHS08 |
| GHS Hazard Statements |
H351:Carcinogenicity |
| Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P308+P313:IF exposed or concerned: Get medical advice/attention. |
COMPUTED DESCRIPTORS
| Molecular Weight | 300.4 g/mol |
|---|---|
| XLogP3 | 7.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| Exact Mass | 300.093900383 g/mol |
| Monoisotopic Mass | 300.093900383 g/mol |
| Topological Polar Surface Area | 0 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 376 |
| 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
Coronene is a ortho- and peri-fused polycyclic arene that consists of six peri-fused benzene rings.