8-Bromo-4-chloro-2-methylquinoline

HCID 768483CAS 1201-07-6

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: Cc1cc(Cl)c2cccc(Br)c2n1
InChIKey: SDVHWORPDUOWDV-UHFFFAOYSA-N
Summenformel: C10H7BrClN
Durchschnittliche Molmasse: 256,52 g/mol
Monoisotopische Masse: 254,94504

Namen und Bezeichner

Bevorzugter Name: 8-Bromo-4-chloro-2-methylquinoline
IUPAC: 8-bromo-4-chloro-2-methylquinoline
Englischer Name: 8-BROMO-4-CHLORO-2-METHYLQUINOLINE
Summenformel: C10H7BrClN
Molmasse: 256.53

Namen und Synonyme

8-Bromo-4-chloro-2-methylquinoline1201-07-6DTXSID20354310RefChem:311831DTXCID50305370802-663-9Quinoline, 8-bromo-4-chloro-2-methyl-MFCD002724322-methyl-4-chloro-8-bromo-quinolineSCHEMBL317207AKOS000618523AB05684

Weitere Namen anzeigen

8-BROMO-4-CHLOROQUINALDINE2-Methyl-4-chloro-8-BroMoquinoline

AC-37177BS-14541C71676EN300-627350AN-584/133692248-Bromo-4-chloro-2-methyl-quinoline8-Bromo-4-chloro-2-methylquinWLZ4059

Datenbank-Bezeichner

CAS: 1201-07-6
PubChem CID: 768483
DTXSID: DTXSID20354310
EC Number: 802-663-9

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,9
Polarare Oberfläche (TPSA): 12,9 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 0
Schwere Atome: 13
Formalladung: 0
Komplexität: 188

Physikochemische Eigenschaften

Siedepunkt: 321.9 · 321.9±37.0 °C(Predicted)
Dichte: 1.591 · 1.591±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Aggregatzustand: powder
pka: 1.71 · 1.71±0.50(Predicted)
Farbe: Light brown
InChI: 1S/C10H7BrClN/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5H,1H3
InChIKey: SDVHWORPDUOWDV-UHFFFAOYSA-N
SMILES: Cc1cc(Cl)c2cccc(Br)c2n1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 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. 3 (100%)；Eye Dam. 1 (100%)

Sicherheitsdaten

wgk: 3
ridadr: UN 2811 6.1 / PGIII
hs_code: 2933499090
risk_code: 25-41
hazard_code: T
safety_code: 26-39-45
Speicherklasse: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications: Acute Tox. 3 OralEye Dam. 1