2-(Bromomethyl)-6-fluoropyridine

HCID 13985218

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Grundinformationen

CAS: 100202-78-6
Standard-SMILES: Fc1cccc(CBr)n1
InChIKey: ADYKBYXVMBDQQX-UHFFFAOYSA-N
Summenformel: C6H5BrFN
Durchschnittliche Molmasse: 190,01 g/mol
Monoisotopische Masse: 188,95894

Namen und Bezeichner

Bevorzugter Name: 2-(Bromomethyl)-6-fluoropyridine
IUPAC: 2-(bromomethyl)-6-fluoropyridine
Englischer Name: 2-(BroMoMethyl)-6-fluoropyridine
Summenformel: C6H5BrFN
Molmasse: 190.01

Namen und Synonyme

2-(Bromomethyl)-6-fluoropyridine100202-78-6DTXSID40553828RefChem:253365DTXCID20504611815-302-5Pyridine, 2-(bromomethyl)-6-fluoro-MFCD099535322-bromomethyl-6-fluoropyridine6-(bromomethyl)-2-fluoropyridine6-fluoro-2-bromomethylpyridine6-Bromomethyl-2-fluoropyridine

Weitere Namen anzeigen

-6-fluoropyridine

SCHEMBL10223052-(bromomethyl)-6-fluoro-pyridine2-bromomethyl-6-fluo2-bromomethyl-6-fluoro-pyridineSCHEMBL29480775ADYKBYXVMBDQQX-UHFFFAOYSA-NAKOS006311939CS-W006122

Datenbank-Bezeichner

CAS: 100202-78-6
PubChem CID: 13985218
DTXSID: DTXSID40553828
EC Number: 815-302-5

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,9
Polarare Oberfläche (TPSA): 12,9 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 9
Formalladung: 0
Komplexität: 89

Physikochemische Eigenschaften

Siedepunkt: 208.8 · 208.8±25.0 °C(Predicted)
Dichte: 1.632 · 1.632±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
pka: -2.22 · -2.22±0.12(Predicted)
Aggregatzustand: liquid
Farbe: Colourless to light yellow

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (25%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (75%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (25%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (25%): 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, 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 3 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.