CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Dark yellow powder; [Sigma-Aldrich MSDS] |
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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 |
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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.