Phenyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone

4-Benzoylbenzeneboronic acid pinacol ester · 4-(Phenylcarbonyl)phenylboronic acid, pinacol ester · 2-(4-benzoylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane · phenyl(4-(4,4,5,5-tetramethyl -1,3,2- dioxaborolan-2-yl) phenyl)methanone · Methanone, phenyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- · PHENYL-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE-2-YL)-PHENYL]-METHANONE

https://huagongshe.com/de/chemical/12158596

Molekülstruktur von Phenyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone

Identifikatoren & physikalische Daten

CAS No.	269410-03-9
Summenformel	C19H21BO3
Durchschnittliche Molmasse	308,2 g/mol
Monoisotopische Masse	308,1583747 g/mol
SMILES	CC1(C)OB(c2ccc(C(=O)c3ccccc3)cc2)OC1(C)C
InChIKey	AKQXNDKEDAWVMZ-UHFFFAOYSA-N
PubChem CID	12158596
EC No.	106-885-0
DTXSID	DTXSID50478836

Chemische & physikalische Eigenschaften

Polarare Oberfläche (TPSA)	35,5
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	3
Schwere Atome	23
Formalladung	0
Komplexität	416
Schmelzpunkt	75-76 °C
Siedepunkt	432.6±28.0 °C(Predicted)
Dichte	1.11±0.1 g/cm3(Predicted)
Lagerbedingungen	2-8°C
Aggregatzustand	solid
InChI	1S/C19H21BO3/c1-18(2)19(3,4)23-20(22-18)16-12-10-15(11-13-16)17(21)14-8-6-5-7-9-14/h5-13H,1-4H3
InChIKey	AKQXNDKEDAWVMZ-UHFFFAOYSA-N
SMILES	B3(OC(C(O3)(C)C)(C)C)c1ccc(cc1)C(=O)c2ccccc2

Sicherheit & Vorschriften

GHS-Einstufung	H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]P273, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Aquatic Chronic 4 (100%)
Wassergefährdungsklasse (WGK)	3
Lagerklasse	11 - Combustible Solids
Gefahrenklasse	Aquatic Chronic 4