320-60-5
Product Name:
2,4-Dichlorobenzotrifluoride
Formula:
C7H3Cl2F3
Synonyms:
2,4-Dichloro-α,α,α-trifluorotoluene
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CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colorless liquid; [Sigma-Aldrich MSDS] |
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Vapor Pressure | 1.11 [mmHg] |
Kovats Retention Index | 992.1 |
Chemical Classes | Other Classes -> Halogenated Monoaromatics |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Corrosion Corrosives GHS05 |
GHS Hazard Statements |
H314:Skin corrosion/irritation H413:Hazardous to the aquatic environment, long-term hazard |
Precautionary Statement Codes |
P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P330+P331:IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. 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 | 215.00 g/mol |
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XLogP3 | 4.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 0 |
Exact Mass | 213.9563900 g/mol |
Monoisotopic Mass | 213.9563900 g/mol |
Topological Polar Surface Area | 0 Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 157 |
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 |