11-Bromo-1-undecene

HCID 284148CAS 7766-50-9

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Grundinformationen

Standard-SMILES: C=CCCCCCCCCCBr
InChIKey: YPLVPFUSXYSHJD-UHFFFAOYSA-N
Summenformel: C11H21Br
Durchschnittliche Molmasse: 233,19 g/mol
Monoisotopische Masse: 232,08266

Namen und Bezeichner

Bevorzugter Name: 11-Bromo-1-undecene
IUPAC: 11-bromoundec-1-ene
Englischer Name: 11-Bromo-1-undecene
Summenformel: C11H21Br
Molmasse: 233.19

Namen und Synonyme

11-Bromo-1-undeceneDTXSID90300900RefChem:437220DTXCID70252034622-571-011-Bromoundec-1-ene7766-50-91-bromo-10-undeceneUndec-10-enyl bromide10-Undecenyl BromideMFCD00040825C11H21Br

Weitere Namen anzeigen

DK907DKFELEX0243Brominated decarbene

n-undecylenic bromide11-bromo-undec-1-ene1-Bromo-10-undecene; 10-Undecenyl bromide; NSC 13987811-bromoundeceneundecylenyl bromideNSC139878w-undecylenyl bromide1-bromundec-10-ene

Datenbank-Bezeichner

CAS: 7766-50-9
PubChem CID: 284148
DTXSID: DTXSID90300900
ChEMBL: CHEMBL1702186
EC Number: 622-571-0
Nikkaji: J533.576K

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 6
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 0
Frei drehbare Bindungen: 9
Schwere Atome: 12
Formalladung: 0
Komplexität: 89

Physikochemische Eigenschaften

Schmelzpunkt: 55 °C · 55 °C
Siedepunkt: 149 · 149-150 °C35 mm Hg(lit.)
Dichte: 1.063 g/mL · 1.063 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.468(lit.)
Flammpunkt: 110 °C · >110°C
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
Löslichkeit: Chloroform (Slightly)
Aggregatzustand: Oil
Farbe: Colourless
Wichte: 1.063 · 1.063
Wasserlöslichkeit: 0.2422 mg/L · Soluble in water, 0.2422 mg/L @ 25°C (est).
BRN: 1753231 · 1753231
Stabilität: Stable. Incompatible with strong oxidizing agents.
InChI: 1S/C11H21Br/c1-2-3-4-5-6-7-8-9-10-11-12/h2H,1,3-11H2
InChIKey: YPLVPFUSXYSHJD-UHFFFAOYSA-N
SMILES: BrCCCCCCCCCC=C
LogP: 5.95 · 5.950 (est)
CAS Datenbank: 7766 · 7766-50-9(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 6 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.