Grundinformationen
- Standard-SMILES
CC1(C)OB(c2ccc(F)cc2)OC1(C)C- InChIKey
SBWKQMCGTSWDPE-UHFFFAOYSA-N- Summenformel
- C12H16BFO2
- Durchschnittliche Molmasse
- 222,07 g/mol
- Monoisotopische Masse
- 222,12273837
Namen und Bezeichner
- Bevorzugter Name
- 2-(4-Fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- IUPAC
- 2-(4-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- Englischer Name
- 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)fluorobenzene
- Summenformel
- C12H16BFO2
- Molmasse
- 222.06
Namen und Synonyme
214360-58-42-(4-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane4-Fluorophenylboronic acid pinacol esterDTXSID20375247RefChem:457702DTXCID40326276671-855-0941-113-34-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluorobenzene4-fluorophenylboronic acid, pinacol esterMFCD03453665C12H16BFO2
Weitere Namen anzeigen
4-FLUOROPHENYLBSWZn-214360-58-44-fluorophenylborate pinacol ester4-Fluorobenzeneboronic acid, pinacol ester 97%1,3,2-Dioxaborolane,2-(4-fluorophenyl)-4,4,5,5-tetraMethyl-1-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene
AKOS0158932684-fluorobenzeneboronic acid, pinacol ester4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-fluorobenzene(4-FLUOROPHENYL)BORONIC ACID PINACOL ESTER1,3,2-DIOXABOROLANE, 2-(4-FLUOROPHENYL)-4,4,5,5-TETRAMETHYL-SCHEMBL10323SCHEMBL2659012SBB096239
Datenbank-Bezeichner
- CAS
214360-58-4- PubChem CID
- 2760593
- DTXSID
DTXSID20375247- EC Number
- 671-855-0、941-113-3
- Nikkaji
- J2.241.261B
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 18,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 16
- Formalladung
- 0
- Komplexität
- 244
Physikochemische Eigenschaften
- Siedepunkt
- 279.4 · 279.4±23.0 °C(Predicted)
- Dichte
- 1.05 · 1.05±0.1 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Aggregatzustand
- powder to lump to clear liquid
- Farbe
- White or Colorless to Light yellow to Light orange
- InChI
- 1S/C12H16BFO2/c1-11(2)12(3,4)16-13(15-11)9-5-7-10(14)8-6-9/h5-8H,1-4H3
- InChIKey
- SBWKQMCGTSWDPE-UHFFFAOYSA-N
- SMILES
- B2(OC(C(O2)(C)C)(C)C)c1ccc(cc1)F
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (95.3%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 5 notifications to the ECHA C&L Inventory.
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Gefahrenhinweise
Hazard Classes and Categories
Acute Tox. 4 (95.3%)
Acute Tox. 4 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2931900090
- risk_code
- 22
- hazard_code
- Xn
- hazard_class
- IRRITANT
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 Oral
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