3-Chloro-6-methylpyridazine
Daten werden ergänzt – lade die Seite später neu, um den aktuellen Stand zu sehen
Grundinformationen
- CAS
1121-79-5- Standard-SMILES
Cc1ccc(Cl)nn1- InChIKey
PRORLQAJNJMGAR-UHFFFAOYSA-N- Summenformel
- C5H5ClN2
- Durchschnittliche Molmasse
- 128,56 g/mol
- Monoisotopische Masse
- 128,0141259
Namen und Bezeichner
- Bevorzugter Name
- 3-Chloro-6-methylpyridazine
- IUPAC
- 3-chloro-6-methylpyridazine
- Englischer Name
- 3-Chloro-6-methylpyridazine
- Summenformel
- C5H5ClN2
- Molmasse
- 128.56
Namen und Synonyme
3-Chloro-6-methylpyridazineDTXSID10280795RefChem:93483DTXCID10231949627-952-5PRORLQAJNJMGAR-UHFFFAOYSA-N1121-79-53-Chloro-6-methyl-pyridazinePYRIDAZINE, 3-CHLORO-6-METHYL-MFCD000529056-chloro-3-methylpyridazineNSC-18704
Weitere Namen anzeigen
NSC 18704AKOS BBS-000015513-Chloro-6-Methylpridazine3-Chloro-6-methylpyridazi...
3-Chloro-6-methyl pyridazine6-Chloro-3-methylpyridazine; NSC 18704;3-Chloro-6-methyl-1,2-diazineNSC187043-chloro-6-methylchloro-6-methylpyridazineSCHEMBL52266-methyl-3-chloropyridazine
Datenbank-Bezeichner
- CAS
1121-79-5- PubChem CID
- 227254
- DTXSID
DTXSID10280795- ChEBI
CHEBI:194649- UNII
- 69FY6863P4
- EC Number
- 627-952-5
- Nikkaji
- J151.404K
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 1,2
- Polarare Oberfläche (TPSA)
- 25,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 76
Physikochemische Eigenschaften
- Schmelzpunkt
- 58 · 58-62 °C
- Siedepunkt
- 58 °C · 58 °C
- Dichte
- 1.234 · 1.234±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Löslichkeit
- DMSO, Methanol (Slightly)
- Aggregatzustand
- Solid
- pka
- 1.26 · 1.26±0.10(Predicted)
- Farbe
- Pale Beige
- BRN
- 108655 · 108655
- InChI
- InChI=1S/C5H5ClN2/c1-4-2-3-5(6)8-7-4/h2-3H,1H3
- InChIKey
- PRORLQAJNJMGAR-UHFFFAOYSA-N
- SMILES
- C1(Cl)=NN=C(C)C=C1
- CAS Datenbank
- 1121 · 1121-79-5(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H302 (89.4%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (87.2%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (87.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (12.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (10.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+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 4 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. 4 (89.4%)；Skin Irrit. 2 (100%)；Skin Sens. 1 (87.2%)；Eye Dam. 1 (87.2%)；Eye Irrit. 2 (12.8%)；STOT SE 3 (10.6%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 29339900
- risk_code
- 20/21/22-36/37/38-43-41-38-22
- hazard_code
- Xn
- hazard_note
- Harmful
Chemie und Industrie
Anwendungen
Verwenden3-Chloro-6-methylpyridazine is used for preparation of heterocyclic compounds as integrase inhibiting antiviral agents.
Vor- und nachgelagerte Produkte
Nachgelagerte Produkte
Zugehörige Reaktionen
102
Notizen zur Verbindung
Wird geladen…