2-Hydroxy-4-(trifluoromethyl)benzaldehyde

2-Hydroxy-4-(trifluoromethyl)benzaldehyde · 2-Hydroxy-4-(trifluoromethyl) · 4-trifluoromethylsalicaldehyde · 4-Trifluoromethylsalicyaldehyde · 2-Formyl-5-(trifluoromethyl)phenol · 4-(Trifluoromethyl)salicylaldehyde · 4-Formyl-3-hydroxybenzotrifluoride · 2-Hydroxy-4-(tifluoromethyl)benzaldehyde

https://huagongshe.com/de/chemical/22493901

Molekülstruktur von 2-Hydroxy-4-(trifluoromethyl)benzaldehyde

Identifikatoren & physikalische Daten

CAS No.	58914-34-4
Summenformel	C8H5F3O2
Durchschnittliche Molmasse	190,12 g/mol
Monoisotopische Masse	190,02416406 g/mol
SMILES	O=Cc1ccc(C(F)(F)F)cc1O
InChIKey	YHYNJGHMBMXAFB-UHFFFAOYSA-N
PubChem CID	22493901
EC No.	829-951-7
DTXSID	DTXSID60626169

Chemische & physikalische Eigenschaften

XLogP	2,5
Polarare Oberfläche (TPSA)	37,3
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	5
Frei drehbare Bindungen	1
Schwere Atome	13
Formalladung	0
Komplexität	190
Siedepunkt	217.8±40.0 °C(Predicted)
Dichte	1.429±0.06 g/cm3(Predicted)
Lagerbedingungen	under inert gas (nitrogen or Argon) at 2-8°C
Löslichkeit	Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand	Solid
pKa (Säurekonstante)	7.17±0.10(Predicted)
Farbe	Colourless to Pale Yellow

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Acute Tox. 4 (50%)
Zollcode	2912210000

Anwendungen & Verwendung

Verwenden

2-Hydroxy-4-(trifluoromethyl)benzaldehyde (cas# 58914-34-4) is used as a reactant in the preparation of flavone derivatives for the treatment and prophylaxis of hepatitis B virus disease.