8-(Bromomethyl)quinoline

HCID 346914CAS 7496-46-0

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Grundinformationen

Standard-SMILES: BrCc1cccc2cccnc12
InChIKey: IAAUGSYGHOFWEW-UHFFFAOYSA-N
Summenformel: C10H8BrN
Durchschnittliche Molmasse: 222,08 g/mol
Monoisotopische Masse: 220,98401

Namen und Bezeichner

Bevorzugter Name: 8-(Bromomethyl)quinoline
IUPAC: 8-(bromomethyl)quinoline
Englischer Name: 8-Bromomethylquinoline
Summenformel: C10H8BrN
Molmasse: 222.08

Namen und Synonyme

8-(Bromomethyl)quinolineDTXSID70323950RefChem:547455DTXCID30275067685-729-87496-46-08-Bromomethylquinoline8-Bromomethyl-quinolineMFCD00047621Quinoline, 8-(bromomethyl)-NSC4052828-(bromo)methylquinoline

Weitere Namen anzeigen

8-QuinolylMethyl broMide8-(Bromomethyl)quinoline ,97%8-(Bromomethyl)-1-azanaphthalene8-(Bromomethyl)quinoline >=96.5% (GC)8-Bromomethylquinoline ISO 9001：2015 REACH

8-Quinolinylmethyl bromideSCHEMBL243081SCHEMBL31261655IAAUGSYGHOFWEW-UHFFFAOYSA-NSMSSF-0625445STR07370SBB070810AKOS001258536

Datenbank-Bezeichner

CAS: 7496-46-0
PubChem CID: 346914
DTXSID: DTXSID70323950
EC Number: 685-729-8
Nikkaji: J1.070.814A

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,6
Polarare Oberfläche (TPSA): 12,9 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 1
Schwere Atome: 12
Formalladung: 0
Komplexität: 149

Physikochemische Eigenschaften

Schmelzpunkt: 81 °C · 81 °C
Siedepunkt: 321.9 · 321.9±17.0 °C(Predicted)
Dichte: 1.518 · 1.518±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Löslichkeit: Dichloromethane
Aggregatzustand: Solid
pka: 3.85 · 3.85±0.17(Predicted)
Farbe: White
BRN: 119140 · 119140

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H318 (95.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 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.