CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid; [HSDB] Brown powder; [MSDSonline] |
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Color/Form | NEEDLES FROM ALCOHOL |
Melting Point | 138-39 °C |
Solubility | SLIGHTLY SOL IN HOT WATER, ALCOHOL; SOL IN ETHER, METHANOL, HOT ALCOHOL |
Vapor Pressure | 0.0000249 [mmHg] |
Kovats Retention Index | 1449 |
Chemical Classes | Other Classes -> Other Organic Compounds |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
![]() Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. 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 | 192.17 g/mol |
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XLogP3 | 0.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 192.04225873 g/mol |
Monoisotopic Mass | 192.04225873 g/mol |
Topological Polar Surface Area | 63.6 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 216 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
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