6-Chlor-3-nitropyridin-2-ylamin
6-Chloro-3-nitropyridin-2-ylamine
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Grundinformationen
- CAS
27048-04-0- Standard-SMILES
Nc1nc(Cl)ccc1[N+](=O)[O-]- InChIKey
WERABQRUGJIMKQ-UHFFFAOYSA-N- Summenformel
- C5H4ClN3O2
- Durchschnittliche Molmasse
- 173,56 g/mol
- Monoisotopische Masse
- 172,99920405
Namen und Bezeichner
- Bevorzugter Name
- 6-Chloro-3-nitropyridin-2-ylamine
- IUPAC
- 6-chloro-3-nitropyridin-2-amine
- Lokaler Name
- 6-Chlor-3-nitropyridin-2-ylamin
- Englischer Name
- 2-Amino-6-chloro-3-nitropyridine
- Summenformel
- C5H4ClN3O2
- Molmasse
- 173.56
Namen und Synonyme
2-Amino-6-chloro-3-nitropyridine27048-04-06-Chloro-3-nitropyridin-2-ylamineEINECS 248-188-5DTXSID40181524RefChem:541676DTXCID80104015248-188-56-chloro-3-nitropyridin-2-amine2-Amino-3-nitro-6-chloropyridine136901-10-5MFCD00044350
Weitere Namen anzeigen
LABOTEST-BB LT000125992-Amino-6-chloro-3-nitrop...2-amino-3-nitrochloropyridine6-Chlor-3-nitropyridin-2-amin2-Amino-3-nitro-6-chloropyridi2-Amino-6-chloro-nitro pyridne2-Amino-6-chlor-3-nitropyridinFlupirtinemaleateintermediateI
6-chloro-3-nitro-2-pyridinamine6-Amino-2-chloro-5-nitropyridine6-chloro-3-nitro-pyridin-2-amine2-Pyridinamine, 6-chloro-3-nitro-6-Chloro-3-nitro-pyridin-2-ylamine6-Chloro-3-nitro-2-pyridylamineSCHEMBL1100926-Chloro-3-nitro-2-aminopyridine
Datenbank-Bezeichner
- CAS
27048-04-0- PubChem CID
- 2724035
- DTXSID
DTXSID40181524- EC Number
- 248-188-5
- Nikkaji
- J308.439F
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 1,8
- Polarare Oberfläche (TPSA)
- 84,7 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 160
Physikochemische Eigenschaften
- Schmelzpunkt
- 195 · 195-196
- Siedepunkt
- 339.9 · 339.9±37.0 °C(Predicted)
- Dichte
- 1.596 · 1.596±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Keep in dark place,Inert atmosphere,2-8°C
- Löslichkeit
- Chloroform, DMSO
- Aggregatzustand
- Crystalline
- pka
- -1.69 · -1.69±0.50(Predicted)
- Farbe
- Yellow
- Wasserlöslichkeit
- Slightly soluble in water. Soluble in dimethyl sulfoxide and chloroform.
- InChI
- InChI=1S/C5H4ClN3O2/c6-4-2-1-3(9(10)11)5(7)8-4/h1-2H,(H2,7,8)
- InChIKey
- WERABQRUGJIMKQ-UHFFFAOYSA-N
- SMILES
- C1(N)=NC(Cl)=CC=C1[N+]([O-])=O
- CAS Datenbank
- 27048 · 27048-04-0(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
This chemical does not meet GHS hazard criteria for 5.3% (1 of 19) of reports.
Warning
H302 (21.1%): 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 19 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory InformationStatus: Active Update: 15-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/23183
Hazard Classes and CategoriesAcute Tox. 4 (21.1%)
Sicherheitsdaten
- ridadr
- 2811
- hs_code
- 29333999
- risk_code
- 36/37/38
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 22-26-36/37/39
- hazard_class
- 6.1
- packing_group
- Ⅲ
Chemie und Industrie
Anwendungen
Beschreibung2-Amino-6-chloro-3-nitropyridine is a cytotoxic drug that has been shown to have anti-viral potency, as well as antiviral activity in an activity test. It is synthesized by reacting hydrogen tartrate with oxadiazole, and then hydrolyzing the resulting product with chloride. 2-Amino-6-chloro-3-nitropyridine has also been shown to inhibit human immunodeficiency virus type 1 (HIV) replication in vitro and to be effective against other viruses such as type 2 influenza. This drug can bind to the viral envelope and inhibit fusion of the viral membrane with host cells by preventing the release of viral contents into the cytoplasm. The binding affinity of 2-amino 6-chloro 3 nitropyridine for chloride may be due to hydrogen bonding interactions.
VerwendenIt is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuffs.
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