Grundinformationen
- Standard-SMILES
Brc1cccc(Br)n1- InChIKey
FEYDZHNIIMENOB-UHFFFAOYSA-N- Summenformel
- C5H3Br2N
- Durchschnittliche Molmasse
- 236,89 g/mol
- Monoisotopische Masse
- 234,8632233
Namen und Bezeichner
- Bevorzugter Name
- 2,6-Dibromopyridine
- IUPAC
- 2,6-dibromopyridine
- Lokaler Name
- 2,6-Dibrompyridin
- Englischer Name
- 2,6-Dibromopyridine
- Summenformel
- C5H3Br2N
- Molmasse
- 236.89
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
626-05-1- PubChem CID
- 12274
- DTXSID
DTXSID30211642- UNII
- D9SBA5R353
- EC Number
- 210-926-9
- Nikkaji
- J32.652F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,9
- Polarare Oberfläche (TPSA)
- 12,9 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 68,8
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 117 · 117-119 °C (lit.)
- Siedepunkt
- 255 °C · 255°C
- Dichte
- 2.0383 · 2.0383 (rough estimate)
- Brechungsindex
- 1.58 · 1.5800 (estimate)
- Flammpunkt
- 213 °C · 213 °C
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- pka
- -3.65 · -3.65±0.10(Predicted)
- Aggregatzustand
- Crystalline Powder
- Farbe
- White to gray or buff
- Wasserlöslichkeit
- insoluble
- BRN
- 108922 · 108922
- InChI
- InChI=1S/C5H3Br2N/c6-4-2-1-3-5(7)8-4/h1-3H
- InChIKey
- FEYDZHNIIMENOB-UHFFFAOYSA-N
- SMILES
- C1(Br)=NC(Br)=CC=C1
- CAS Datenbank
- 626 · 626-05-1(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H300 (96.7%): Fatal if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+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 60 reports by companies from 14 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Pyridine, 2,6-dibromo-
Status: Active Update: 25-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/20034
2,6-Dibromopyridine: Does not have an individual approval but may be used under an appropriate group standard
CSL Reaction Information
CSL00134
OXYGEN + COPPER(II) CHLORIDE DIHYDRATE + 2,6-DIBROMOPYRIDINE + N-BUTYLLITHIUM + DIETHYL ETHER
O2 reacted with the organocopper (or remaining organolithium) reagent to form some peroxides which exploded
Explosive
Ullmann coupling
ACS Safety Letters
Sicherheitsdaten
- wgk
- 3
- ridadr
- 2811
- hs_code
- 29333999
- RTECS-Nr.
- US7883000
- risk_code
- 36/37/38-25-20/21-52-28-52/53-36/38
- hazard_code
- Xi,T,T+
- hazard_note
- Irritant
- safety_code
- 26-37/39-45-36/37/39-36-36/37-28-61
- hazard_class
- 6.1
- packing_group
- II
- Speicherklasse
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- Acute Tox. 2 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Beschreibung2,6-Dibromopyridine is a halogenated pyridine compound used as a pharmaceutical intermediate in the synthesis of the migraine drug (Lasmiditan).Lasmiditan is an oral prescription drug used to treat acute migraine headaches with or without aura. It is important to note that it is not used for migraine prevention.
Verwenden2,6-Dibromopyridine is used as a tridentate chelating ligand and in the formation of macrocycles containing the terpyridine moiety. It is also used to produce 6-bromo-2-methoxypyridine.
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