Grundinformationen
- Standard-SMILES
Brc1cncc(Br)c1- InChIKey
SOSPMXMEOFGPIM-UHFFFAOYSA-N- Summenformel
- C5H3Br2N
- Durchschnittliche Molmasse
- 236,89 g/mol
- Monoisotopische Masse
- 234,86322
Namen und Bezeichner
- Bevorzugter Name
- 3,5-Dibromopyridine
- IUPAC
- 3,5-dibromopyridine
- Lokaler Name
- 3,5-Dibrompyridin
- Englischer Name
- 3,5-Dibromopyridine
- Summenformel
- C5H3Br2N
- Molmasse
- 236.89
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
625-92-3- PubChem CID
- 69369
- DTXSID
DTXSID3073921- ChEBI
CHEBI:51593- EC Number
- 210-916-4
- Nikkaji
- J79.765K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,2
- 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
Physikochemische Eigenschaften
- Schmelzpunkt
- 110 · 110-115 °C (lit.)
- Siedepunkt
- 222 °C · 222 °C
- Dichte
- 2.0383 · 2.0383 (rough estimate)
- Brechungsindex
- 1.58 · 1.5800 (estimate)
- storage temp.
- Inert atmosphere,Room Temperature
- Löslichkeit
- DMSO (Slightly, Heated), Methanol (Slightly)
- pka
- 0.52 · 0.52±0.20(Predicted)
- Aggregatzustand
- Needle-Like Crystals
- Farbe
- White to light beige
- Wasserlöslichkeit
- Soluble in Chloroform and Methanol. Insoluble in water.
- BRN
- 108477 · 108477
- InChI
- 1S/C5H3Br2N/c6-4-1-5(7)3-8-2-4/h1-3H
- InChIKey
- SOSPMXMEOFGPIM-UHFFFAOYSA-N
- SMILES
- Brc1cncc(Br)c1
- CAS Datenbank
- 625 · 625-92-3(CAS DataBase Reference)
- NIST chemische Informationen
- 3 · 3,5-Dibromopyridine(625-92-3)
- EPA chemische Informationen
- 3 · 3,5-Dibromopyridine (625-92-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (18.9%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (15.1%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (15.1%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (96.2%): 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, 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 53 reports by companies from 10 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
Regulatorische Informationen
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN2811
- hs_code
- 29333999
- risk_code
- 36/37/38-20/21/22
- hazard_code
- Xi,Xn
- safety_code
- 26-36-36/37/39
- hazard_class
- IRRITANT
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2
Chemie und Industrie
Anwendungen
Verwenden3-Acetylamino-5-ethoxypyridine was prepared by converting 3, 5-dibromopyridine with sodium ethylate into 3-bromo-5-ethoxypyridine, allowing this substance to interact with ammonia and acetylating the aminoethoxypyridine thus formed with acetic anhydride. Lithiation of 3, 5-dibromopyridine with LDA and subsequent reaction with electrophiles provided 4-alkyl-3, 5-dibromopyridines 2 in high yield. Ligand was prepared by a Pd(0)-catalyzed cross-coupling reaction of 3,5-dibromopyridine and 5-tributylstannyl-3,3-bipyridine. The synthesis of 3, 5-bis (2-indolyl) pyridine and 3-[(2-indolyl)-5-phenyl] pyridine derivatives as includes Stille or Suzuki type reactions, which were realized on the 3,5-dibromopyridine.
Vor- und nachgelagerte Produkte
Nachgelagerte Produkte
Anbieter50 Anbieter
Zugehörige Reaktionen
Verknüpfte Notizen
Wird geladen…