2-(Trifluoromethyl)phenylhydrazine

BUTTP · BUTTPARK 44\57-17 · AKOS BBS-00006978 · à,à,à-trifluoro-o-tolylhydrazine · α,α,α-Trifluoro-o-tolylhydrazine · 2-(TRIFLUOROMETHYL)PHENYLHYDRAZINE · [o-(Trifluoromethyl)phenyl]hydrazine · 2-(Trifluoromethyl)phenylhydrazine98%

https://huagongshe.com/de/chemical/520800

Molekülstruktur von 2-(Trifluoromethyl)phenylhydrazine

Identifikatoren & physikalische Daten

CAS No.	365-34-4
Summenformel	C7H7F3N2
Durchschnittliche Molmasse	176,14 g/mol
Monoisotopische Masse	176,05613288 g/mol
SMILES	NNc1ccccc1C(F)(F)F
InChIKey	JSWQDLBFVSTSIW-UHFFFAOYSA-N
PubChem CID	520800
ChEMBL	CHEMBL1621897
EC No.	609-255-8
DTXSID	DTXSID70334460

Chemische & physikalische Eigenschaften

XLogP	2,6
Polarare Oberfläche (TPSA)	38,1
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	5
Frei drehbare Bindungen	1
Schwere Atome	12
Formalladung	0
Komplexität	146
Schmelzpunkt	55-58°C
Siedepunkt	221.5±40.0 °C(Predicted)
Dichte	1.359±0.06 g/cm3(Predicted)
pKa (Säurekonstante)	4.34±0.10(Predicted)
Aggregatzustand	crystalline solid
Farbe	Pale brown
Löslichkeit	Insoluble in water.
BRN	641592
InChI	1S/C7H7F3N2/c8-7(9,10)5-3-1-2-4-6(5)12-11/h1-4,12H,11H2
InChIKey	JSWQDLBFVSTSIW-UHFFFAOYSA-N
SMILES	NNc1ccccc1C(F)(F)F
CAS Datenbank	365-34-4(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (97.8%): 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 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Acute Tox. 4 (97.8%)
Wassergefährdungsklasse (WGK)	3
UN-Transportnummer	UN2811
Zollcode	2928009090
R-Sätze (R)	20/21/22-36/37/38-22
Gefahrensymbole	Xi,Xn
hazard_note	Irritant
Sicherheitshinweise (S)	26-36/37/39-36
Gefahrenklasse	IRRITANT, IRRITANT-HARMFULAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Lagerklasse	11 - Combustible Solids

Anwendungen & Verwendung

Verwenden

2-(Trifluoromethyl)phenylhydrazine is used as an intermediate in organic syntheses. It is also ued as a fine chemical intermediate, GC derivatizing agent, coupling reagent and N- protecting agent.