Ethyl 4-chloro-7-methyl-1,8-naphthyridine-3-carboxylate
Grundinformationen
- CAS
33331-57-6- Standard-SMILES
CCOC(=O)c1cnc2nc(C)ccc2c1Cl- InChIKey
HKTABMXYYNWMQH-UHFFFAOYSA-N- Summenformel
- C12H11ClN2O2
- Durchschnittliche Molmasse
- 250,68 g/mol
- Monoisotopische Masse
- 250,0509053
Namen und Bezeichner
- Bevorzugter Name
- Ethyl 4-chloro-7-methyl-1,8-naphthyridine-3-carboxylate
- IUPAC
- ethyl 4-chloro-7-methyl-1,8-naphthyridine-3-carboxylate
- Englischer Name
- 4-Chloro-7-methyl-[1,8]naphthyridine-3-carboxylic acid ethyl ester
- Summenformel
- C12H11ClN2O2
- Molmasse
- 250.68
Namen und Synonyme
Ethyl 4-chloro-7-methyl-1,8-naphthyridine-3-carboxylate33331-57-6DTXSID10441809RefChem:343913DTXCID60392630887-027-94-Chloro-7-methyl-[1,8]naphthyridine-3-carboxylic acid ethyl ester3-Carbethoxy-4-chloro-7-methyl-1,8-naphthyridineSCHEMBL2022576HKTABMXYYNWMQH-UHFFFAOYSA-NIBA33157MFCD09837246
Weitere Namen anzeigen
1,8-Naphthyridine-3-carboxylic acid, 4-chloro-7-methyl-, ethyl ester
AKOS000320279DB-128906EN300-77527G44795Ethyl4-chloro-7-methyl-1,8-naphthyridine-3-carboxylateEthyl 4-Chloro-7-methyl-[1,8]naphthyridine-3-carboxylate4-chloro-7-methyl-1,8-Naphthyridine-3-carboxylic acid ethyl ester
Datenbank-Bezeichner
- CAS
33331-57-6- PubChem CID
- 10562672
- DTXSID
DTXSID10441809- EC Number
- 887-027-9
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,7
- Polarare Oberfläche (TPSA)
- 52,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 17
- Formalladung
- 0
- Komplexität
- 288
Physikochemische Eigenschaften
- Siedepunkt
- 344.4 · 344.4±37.0 °C(Predicted)
- Dichte
- 1.301 · 1.301±0.06 g/cm3(Predicted)
- pka
- 1.58 · 1.58±0.30(Predicted)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302
Chemie und Industrie
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