4-Chloro-2-(trifluoromethyl)phenylboronic Acid
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Grundinformationen
- CAS
313545-41-4- Standard-SMILES
OB(O)c1ccc(Cl)cc1C(F)(F)F- InChIKey
YAPBOBGBYQQYHX-UHFFFAOYSA-N- Summenformel
- C7H5BClF3O2
- Durchschnittliche Molmasse
- 224,37 g/mol
- Monoisotopische Masse
- 224,0023217
Namen und Bezeichner
- Bevorzugter Name
- 4-Chloro-2-(trifluoromethyl)phenylboronic Acid
- IUPAC
- [4-chloro-2-(trifluoromethyl)phenyl]boronic acid
- Englischer Name
- 2-Chloro-4-(trifluoromethyl)phenylboronic acid
- Summenformel
- C7H5BClF3O2
- Molmasse
- 224.37
Namen und Synonyme
313545-41-44-Chloro-2-(trifluoromethyl)phenylboronic acidDTXSID40376837RefChem:291475DTXCID00327865672-938-44-Chloro-2-trifluoromethylphenylboronic acid[4-chloro-2-(trifluoromethyl)phenyl]boronic Acid4-Chloro-2-(trifluoromethyl)benzeneboronic acid4-Chloro-2-(trifluoromethyl)phenylboronicacidMFCD04973086(4-chloro-2-(trifluoromethyl)phenyl)boronic acid
Weitere Namen anzeigen
AKOS BRN-0574AKOS BRN-10192-Borono-5-chlorobenzotrifluoride4-Chloro-2-trifluoroMethylphenylboronic2-chloro-4-trifluoromethphenylboronic acid4-chloro-2-trilfuoromethylphenylboronic acid2-Chloro-4-(trifluoromethyl)phenylboronic acid2-CHLORO-4-(TRIFLUOROMETHYL)BENZENEBORONIC ACID
AB21257Boronic acid, B-[4-chloro-2-(trifluoromethyl)phenyl]-NCGC00249540-01AC-23658SY015335C2601EN300-1262815Boronic acid, [4-chloro-2-(trifluoromethyl)phenyl]-
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- Polarare Oberfläche (TPSA)
- 40,5 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 200
Physikochemische Eigenschaften
- Schmelzpunkt
- 70 · 70-72
- Siedepunkt
- 287.6 · 287.6±50.0 °C(Predicted)
- Dichte
- 1.49 · 1.49±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Löslichkeit
- soluble in Methanol
- Aggregatzustand
- powder to crystal
- pka
- 7.97 · 7.97±0.58(Predicted)
- Farbe
- White to Almost white
- InChI
- 1S/C7H5BClF3O2/c9-4-1-2-6(8(13)14)5(3-4)7(10,11)12/h1-3,13-14H
- InChIKey
- YAPBOBGBYQQYHX-UHFFFAOYSA-N
- SMILES
- OB(C1=CC=C(Cl)C=C1C(F)(F)F)O
- CAS Datenbank
- 313545 · 313545-41-4(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H302 (11.1%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (88.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (77.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 9 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (11.1%)；Skin Irrit. 2 (88.9%)；Eye Irrit. 2A (100%)；STOT SE 3 (77.8%)
Sicherheitsdaten
- hs_code
- 29319090
- risk_code
- 36-36/37/38
- hazard_code
- Xi
- safety_code
- 26-37
- hazard_class
- IRRITANT
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2
Chemie und Industrie
Anwendungen
Verwendensuzuki reaction
Anbieter100 Anbieter
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海莉凯化工技术有限公司16628776521 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
Zugehörige Reaktionen
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