2-Amino-4-fluoropyridine

HCID 18327808

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Grundinformationen

CAS: 944401-77-8
Standard-SMILES: Nc1cc(F)ccn1
InChIKey: WCCFLOQQACDOAX-UHFFFAOYSA-N
Summenformel: C5H5FN2
Durchschnittliche Molmasse: 112,1 g/mol
Monoisotopische Masse: 112,04367633

Namen und Bezeichner

Bevorzugter Name: 2-Amino-4-fluoropyridine
IUPAC: 4-fluoropyridin-2-amine
Englischer Name: 2-Amino-4-fluoropyridine
Summenformel: C5H5FN2
Molmasse: 112.11

Namen und Synonyme

2-Amino-4-fluoropyridineRefChem:464294815-037-5944401-77-84-fluoropyridin-2-amineMFCD092609064-FLUORO-2-PYRIDINAMINE4-FLUORO-PYRIDIN-2-YLAMINE4-fluoro-pyridin-2-amineAKOS006238128HY-W005118AB50025

Weitere Namen anzeigen

2-PyridinaMine,4-fluoro-22-Amino-4-fluoropyridine2-Amino-4-Fluoropyridine(WX609167)2-AMINO-4-FLUOROPYRIDINE ISO 9001：2015 REACH

TS-01558AM200616374-fluoro-2-pyridylamineAmino-4-fluoropyridineFT-0648790SCHEMBL310167BCP264orb2940383

Datenbank-Bezeichner

CAS: 944401-77-8
PubChem CID: 18327808
DTXSID: DTXSID20592836
EC Number: 815-037-5
Nikkaji: J3.499.743H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,6
Polarare Oberfläche (TPSA): 38,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 0
Schwere Atome: 8
Formalladung: 0
Komplexität: 76

Physikochemische Eigenschaften

Schmelzpunkt: 102 °C · 102 °C
Siedepunkt: 211.5 · 211.5±20.0 °C(Predicted)
Dichte: 1.257 · 1.257±0.06 g/cm3(Predicted)
storage temp.: 2 · Keep in dark place,Inert atmosphere,2-8°C
Aggregatzustand: Solid
pka: 6.42 · 6.42±0.11(Predicted)
Farbe: Pale yellow
Wasserlöslichkeit: Slightly soluble in water.
InChI: InChI=1S/C5H5FN2/c6-4-1-2-8-5(7)3-4/h1-3H,(H2,7,8)
InChIKey: WCCFLOQQACDOAX-UHFFFAOYSA-N
SMILES: C1(N)=NC=CC(F)=C1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (25%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (75%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (25%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (25%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (50%): 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, P305+P354+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 4 reports by companies from 4 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 CategoriesAcute Tox. 4 (50%)；Acute Tox. 4 (25%)；Skin Irrit. 2 (75%)；Eye Dam. 1 (25%)；Eye Irrit. 2 (75%)；Acute Tox. 4 (25%)；STOT SE 3 (50%)

Sicherheitsdaten

hs_code: 2933399990
hazard_class: IRRITANT

Chemie und Industrie

Anwendungen

Beschreibung2-Amino-4-fluoropyridine is a biochemical reagent that can be used as a biological material or organic compound for life science related research.

VerwendenIt is an important raw material and intermediate used in organic synthesis agrochemical, pharmaceutical and dyestuff field.