2-Fluoro-3-trifluoromethylbenzylamine

HCID 2737565

Notizen Reaktionen

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

CAS: 239135-49-0
Standard-SMILES: NCc1cccc(C(F)(F)F)c1F
InChIKey: PQUYJDPJHOSOTN-UHFFFAOYSA-N
Summenformel: C8H7F4N
Durchschnittliche Molmasse: 193,14 g/mol
Monoisotopische Masse: 193,05146188

Namen und Bezeichner

Bevorzugter Name: 2-Fluoro-3-trifluoromethylbenzylamine
IUPAC: [2-fluoro-3-(trifluoromethyl)phenyl]methanamine
Englischer Name: 2-Fluoro-3-(trifluoromethyl)benzylamine
Summenformel: C8H7F4N
Molmasse: 193.14

Namen und Synonyme

239135-49-02-fluoro-3-trifluoromethylbenzylamineDTXSID30372146RefChem:260892DTXCID903231792-Fluoro-3-(trifluoromethyl)benzylamine(2-fluoro-3-(trifluoromethyl)phenyl)methanamine[2-fluoro-3-(trifluoromethyl)phenyl]methanamineMFCD00061161[2-fluoro-3-(trifluoromethyl)phenyl]methylamineBenzenemethanamine, 2-fluoro-3-(trifluoromethyl)-1-[2-FLUORO-3-(TRIFLUOROMETHYL)PHENYL]METHANAMINE

Weitere Namen anzeigen

RARECHEM AL BW 05372-Fluoro-3-trifluoromethylbenzylami2-Fluoro-3-(trifluoromethyl)benzylamine97%2-Fluoro-3-(trifluoromethyl)benzylamine 97%

SCHEMBL41932SCHEMBL41933CL8678SBB091541AKOS005256288CS-W010694FF85119PS-8319

Datenbank-Bezeichner

CAS: 239135-49-0
PubChem CID: 2737565
DTXSID: DTXSID30372146
EC Number: 671-883-3

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 26 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 1
Schwere Atome: 13
Formalladung: 0
Komplexität: 168

Physikochemische Eigenschaften

Siedepunkt: 193 °C · 193°C
Dichte: 1 · 1,321 g/cm3
Brechungsindex: 1.4548 · 1.4548
Flammpunkt: 83 °C · 83°C
storage temp.: Store under nitrogen
pka: 8.27 · 8.27±0.10(Predicted)
Aggregatzustand: liquid
Farbe: Colourless
Wasserlöslichkeit: Not miscible or difficult to mix in water.
CAS Datenbank: 239135 · 239135-49-0(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H314 (80%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (20%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (20%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (20%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (20%)；Eye Irrit. 2 (20%)；STOT SE 3 (20%)

Sicherheitsdaten

ridadr: 2735
hs_code: 2921490090
risk_code: 34-36/37/38
hazard_code: C,Xi
hazard_note: Corrosive/Store under nitrogen
safety_code: 26-36/37/39-45-36
hazard_class: 8
packing_group: II

Chemie und Industrie

Anwendungen

Verwenden2-Fluoro-3-(trifluoromethyl)benzylamine is an important raw material and intermediate used in organic synthesis, pharmaceuticals and agrochemicals.