Tetrafluoro-1,4-benzoquinone - CAS 527-21-9
Catalog: |
BB027919 |
Product Name: |
Tetrafluoro-1,4-benzoquinone |
CAS: |
527-21-9 |
Synonyms: |
2,3,5,6-tetrafluorocyclohexa-2,5-diene-1,4-dione |
IUPAC Name: | 2,3,5,6-tetrafluorocyclohexa-2,5-diene-1,4-dione |
Description: | Tetrafluoro-1,4-benzoquinone (CAS# 527-21-9) is a useful research chemical. |
Molecular Weight: | 180.06 |
Molecular Formula: | C6F4O2 |
Canonical SMILES: | C1(=C(C(=O)C(=C(C1=O)F)F)F)F |
InChI: | InChI=1S/C6F4O2/c7-1-2(8)6(12)4(10)3(9)5(1)11 |
InChI Key: | JKLYZOGJWVAIQS-UHFFFAOYSA-N |
Boiling Point: | 133.1 ℃ at 760 mmHg |
Melting Point: | 300 ℃ |
Purity: | > 98.0 % (T) (HPLC) |
Density: | 1.62 g/cm3 |
Appearance: | Light yellow to brown powder to crystal |
Storage: | Store under inert gas |
MDL: | MFCD00001592 |
LogP: | 1.43940 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse. |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113048846-A | Application of TMPD-TXBQ eutectic material in laser ignition | 20210312 |
WO-2021166702-A1 | Method for producing aldehyde compound or derivative thereof | 20200217 |
WO-2021132640-A1 | Method for stabilizing perfluorodioxolane compound, composition including perfluorodioxolane compound, and method for manufacturing perfluorodioxolane compound polymer | 20191226 |
CN-113087600-A | Synthesis method of 1, 4-dimethoxy tetrafluorobenzene | 20191223 |
WO-2021130057-A1 | Dehydrogenation process | 20191223 |
PMID | Publication Date | Title | Journal |
21300564 | 20110401 | Spectrophotometric and fluorescence quenching studies of the charge transfer complexation of (4-dimethylamino-benzylidene)-(4,6-dimethyl-pyrimidin-2-yl)-amine with some organic acceptors | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
20496056 | 20100701 | Detection and mechanistic investigation of halogenated benzoquinone induced DNA damage by photoelectrochemical DNA sensor | Analytical and bioanalytical chemistry |
19928783 | 20091218 | Spin-carrying benzoquinone derivatives | The Journal of organic chemistry |
19473021 | 20090625 | Influence of solvent on photoinduced electron-transfer reaction: time-resolved resonance Raman study | The journal of physical chemistry. A |
17716903 | 20070925 | Bioluminescent monitoring of detoxification processes: activity of humic substances in quinone solutions | Journal of photochemistry and photobiology. B, Biology |
Complexity: | 278 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.98344189 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.98344189 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 34.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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