5-(Pyridin-2-yl)-2(1H)-pyridone
Grundinformationen
- CAS
381233-78-9- Standard-SMILES
O=c1ccc(-c2ccccn2)c[nH]1- InChIKey
NHWKTZWOSIVHOL-UHFFFAOYSA-N- Summenformel
- C10H8N2O
- Durchschnittliche Molmasse
- 172,18 g/mol
- Monoisotopische Masse
- 172,06366288
Namen und Bezeichner
- Bevorzugter Name
- 5-(Pyridin-2-yl)-2(1H)-pyridone
- IUPAC
- 5-pyridin-2-yl-1H-pyridin-2-one
- Englischer Name
- 5-(2-Pyridyl)-1,2-dihydropyridin-2-one
- Summenformel
- C10H8N2O
- Molmasse
- 172.18
Namen und Synonyme
381233-78-9[2,3'-Bipyridin]-6'(1'H)-one5-(Pyridin-2-yl)-2(1H)-pyridoneMZQ94VE434DTXSID80437133(2,3'-Bipyridin)-6'(1'H)-oneRefChem:1072585DTXCID303879575-(2-PYRIDYL)-1,2-DIHYDROPYRIDIN-2-ONE5-pyridin-2-yl-1H-pyridin-2-one5-(pyridin-2-yl)-1,2-dihydropyridin-2-one5-(2-Pyridyl)pyridin-2(1H)-one
Weitere Namen anzeigen
3'-bipyridin]-6'-olPerampanel Impurity 12,3'-bipyridin]-6'-ol5-(2-PYRIDYL)-2-PYRIDONEPerampanel Intermediate 12,3'-Bipyridin]-6'(1'H)-one[2,3'-bipyridine]-6'(1'H)-one
MFCD111134145-(PYRIDIN-2-YL)PYRIDIN-2(1H)-ONE5-(Pyridin-2-yl)-2(1H)-pyridone;Pyronoprene Impurity 472,3'-bipyridin-6'-oneSCHEMBL688244SCHEMBL2174182SCHEMBL2175493
Datenbank-Bezeichner
- CAS
381233-78-9- PubChem CID
- 10241257
- DTXSID
DTXSID80437133
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,3
- Polarare Oberfläche (TPSA)
- 42 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 268
Physikochemische Eigenschaften
- Schmelzpunkt
- 71 · 71-75°C
- Siedepunkt
- 434.3 · 434.3±45.0 °C(Predicted)
- Dichte
- 1.221 · 1.221±0.06 g/cm3 (20 ºC 760 Torr)
- storage temp.
- Sealed in dry,Room Temperature
- Löslichkeit
- Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
- pka
- 10.85 · 10.85±0.10(Predicted)
- Aggregatzustand
- Solid
- Farbe
- White
- InChI
- InChI=1S/C10H8N2O/c13-10-5-4-8(7-12-10)9-3-1-2-6-11-9/h1-7H,(H,12,13)
- InChIKey
- NHWKTZWOSIVHOL-UHFFFAOYSA-N
- SMILES
- C1(C2C=CC(=O)NC=2)=NC=CC=C1
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 60% (3 of 5) of all reports.
Warning
H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral]
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 5 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory InformationStatus: Active Update: 03-02-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/34477
Hazard Classes and CategoriesAcute Tox. 4 (20%)
Sicherheitsdaten
- hs_code
- 29333990
Chemie und Industrie
Anwendungen
Verwenden5-(2-Pyridyl)-1,2-dihydropyridin-2-one is used in the synthesis of AMPA receptor antagonists in the treatment of neurological diseases causing dysfunction of glutamatergic neurotransmission.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Zugehörige Reaktionen
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Notizen zur Verbindung
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