2,2,2-Trifluoro-1-(pyridin-2-yl)ethan-1-amine

HCID 25219911

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Grundinformationen

CAS: 503173-14-6
Standard-SMILES: NC(c1ccccn1)C(F)(F)F
InChIKey: SYBAWUSIVYUZIZ-UHFFFAOYSA-N
Summenformel: C7H7F3N2
Durchschnittliche Molmasse: 176,14 g/mol
Monoisotopische Masse: 176,05613272

Namen und Bezeichner

Bevorzugter Name: 2,2,2-Trifluoro-1-(pyridin-2-yl)ethan-1-amine
IUPAC: 2,2,2-trifluoro-1-pyridin-2-ylethanamine
Englischer Name: 2,2,2-Trifluoro-1-pyridin-2-yl-ethylamine
Summenformel: C7H7F3N2
Molmasse: 176.14

Namen und Synonyme

2,2,2-TRIFLUORO-1-(PYRIDIN-2-YL)ETHAN-1-AMINEDTXSID00649296RefChem:1058949DTXCID206000462,2,2-trifluoro-1-(pyridin-2-yl)ethanamine503173-14-62,2,2-Trifluoro-1-pyridin-2-yl-ethylamine2,2,2-trifluoro-1-pyridin-2-ylethanamineMFCD05864540(1S)-2,2,2-TRIFLUORO-1-(2-PYRIDYL)ETHYLAMINE2,2,2-trifluoro-1-(2-pyridyl)ethanamineSCHEMBL566755

Weitere Namen anzeigen

α-(Trifluoromethyl)-2-pyridinemethanamine2-PyridineMethanaMine, a-(trifluoroMethyl)-2-Pyridinemethanamine, α-(trifluoromethyl)-2-Pyridinemethanamine, .alpha.-(trifluoromethyl)-(2,2,2-Trifluoro-1-pyridin-2-ylethyl)amine dihydrochloride2,2,2-trifluoro-1-(pyridin-2-yl)ethanamine dihydrochloride(2,2,2-trifluoro-1-pyridin-2-ylethyl)amine(SALTDATA: FREE)

ALBB-007848STK500794AKOS005171717AB22803AB39753AB39755SB37375BS-28515

Datenbank-Bezeichner

CAS: 503173-14-6
PubChem CID: 25219911
DTXSID: DTXSID00649296
EC Number: 800-748-5
Nikkaji: J2.738.707A

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,9
Polarare Oberfläche (TPSA): 38,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 1
Schwere Atome: 12
Formalladung: 0
Komplexität: 146

Physikochemische Eigenschaften

Siedepunkt: 207.8 · 207.8±40.0 °C(Predicted)
Dichte: 1.292 · 1.292±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)
pka: 5.28 · 5.28±0.39(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.