2-Ethoxy-1,2-diphenylethan-1-on

2-Ethoxybenzoin · PS-8A · Zinc00042732 · Zinc00042733 · Benzoin ethyl · Ethoxybenzoin · O-ETHYLBENZOIN · 2-Ethylbenzoin

Identifikatoren & physikalische Daten

CAS No.	574-09-4
Summenformel	C16H16O2
Durchschnittliche Molmasse	240,3 g/mol
Monoisotopische Masse	240,11502975 g/mol
SMILES	CCOC(C(=O)c1ccccc1)c1ccccc1
InChIKey	KMNCBSZOIQAUFX-UHFFFAOYSA-N
PubChem CID	101778
EC No.	209-366-8
DTXSID	DTXSID40862220
Lokaler Name	2-Ethoxy-1,2-diphenylethan-1-on

XLogP	3
Polarare Oberfläche (TPSA)	26,3
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	5
Schwere Atome	18
Formalladung	0
Komplexität	250
Stoffklassen	Other Classes -> Other Aromatic Compounds
Physical Description	White crystalline powder[Alfa Aesar MSDS]
Schmelzpunkt	59-61 °C(lit.)
Siedepunkt	194-195°C 20mm
Dichte	1.1016
Brechungsindex	1.5727
Flammpunkt	194-195°C/20mm
Lagerbedingungen	Store below +30°C.
Löslichkeit	almost transparency in Methanol
Aggregatzustand	powder to crystal
Farbe	White to Almost white
Merck	14,1093
BRN	2053926
Kosmetik-Inhaltsstoffe Funktionen	FILM FORMING
InChI	InChI=1S/C16H16O2/c1-2-18-16(14-11-7-4-8-12-14)15(17)13-9-5-3-6-10-13/h3-12,16H,2H2,1H3
InChIKey	KMNCBSZOIQAUFX-UHFFFAOYSA-N
SMILES	C(=O)(C1=CC=CC=C1)C(OCC)C1=CC=CC=C1
CAS Datenbank	574-09-4(CAS DataBase Reference)
EPA chemische Informationen	Ethanone, 2-ethoxy-1,2-diphenyl- (574-09-4)

GHS-Einstufung	WarningH317 (88.4%): May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Regulatorische Informationen	Chemical: Ethanone, 2-ethoxy-1,2-diphenyl-Ethanone, 2-ethoxy-1,2-diphenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Gefahrenübersicht	An irritant[Alfa Aesar MSDS] See Benzoin.
Hazard Classes and Categories	Skin Sens. 1 (88.4%)
Wassergefährdungsklasse (WGK)	2
TSCA-Inventar-Status	TSCA listed
UN-Transportnummer	UN 3077 9/PG 3
Zollcode	2914 50 00
R-Sätze (R)	43-50/53
Gefahrensymbole	Xi,N
Sicherheitshinweise (S)	36/37-60-61
Gefahrenklasse	9
Verpackungsgruppe	III
Lagerklasse	11 - Combustible Solids