3-Bromo-4-fluorobenzotrifluoride - CAS 68322-84-9
Catalog: |
BB033520 |
Product Name: |
3-Bromo-4-fluorobenzotrifluoride |
CAS: |
68322-84-9 |
Synonyms: |
2-bromo-1-fluoro-4-(trifluoromethyl)benzene |
IUPAC Name: | 2-bromo-1-fluoro-4-(trifluoromethyl)benzene |
Description: | 3-Bromo-4-fluorobenzotrifluoride (CAS# 68322-84-9) is a useful research chemical. |
Molecular Weight: | 243.00 |
Molecular Formula: | C7H3BrF4 |
Canonical SMILES: | C1=CC(=C(C=C1C(F)(F)F)Br)F |
InChI: | InChI=1S/C7H3BrF4/c8-5-3-4(7(10,11)12)1-2-6(5)9/h1-3H |
InChI Key: | RZJOIMPUMMQKFR-UHFFFAOYSA-N |
Boiling Point: | 148-149 ℃ |
Purity: | 95 % |
Density: | 1.706 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00040938 |
LogP: | 3.60700 |
GHS Hazard Statement: | H227 (12.5%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111825660-A | Compound, thermal activation delayed fluorescence material, organic electroluminescent device and application | 20190419 |
WO-2020146682-A1 | Carboxamides as modulators of sodium channels | 20190110 |
EP-3581570-A1 | Carbazole-pyridine-trifluoromethylphenyl derivatives and related compounds for use as tadf luminescent emitters in oleds | 20180615 |
EP-3581570-B1 | Carbazole-pyridine-trifluoromethylphenyl derivatives and related compounds for use as tadf luminescent emitters in oleds | 20180615 |
DE-102018107166-A1 | Organic molecules, in particular for use in optoelectronic devices | 20180326 |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.93543 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.93543 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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