CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | White needles; [TCI America MSDS] |
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Vapor Pressure | 0.0000182 [mmHg] |
Collision Cross Section | 142.8 Ų [M*]+ 143.9 Ų [M+H]+ |
Kovats Retention Index | 1999.8 2008.2 1979 2037 2037 1983 2037 337.8 340.1 344.9 338.6 |
Chemical Classes | Other Classes -> Polycyclic Aromatic Hydrocarbons |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
COMPUTED DESCRIPTORS
Molecular Weight | 206.28 g/mol |
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XLogP3 | 5.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 0 |
Rotatable Bond Count | 0 |
Exact Mass | 206.109550447 g/mol |
Monoisotopic Mass | 206.109550447 g/mol |
Topological Polar Surface Area | 0 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 218 |
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 |