Grundinformationen
- Standard-SMILES
COc1c(Cl)cc([N+](=O)[O-])cc1Cl- InChIKey
GJYVJKPFYCKNEC-UHFFFAOYSA-N- Summenformel
- C7H5Cl2NO3
- Durchschnittliche Molmasse
- 222,02 g/mol
- Monoisotopische Masse
- 220,96464838
Namen und Bezeichner
- Bevorzugter Name
- 1,3-Dichloro-2-methoxy-5-nitrobenzene
- IUPAC
- 1,3-dichloro-2-methoxy-5-nitrobenzene
- Englischer Name
- 2,6-Dichloro-4-nitroanisole
- Summenformel
- C7H5Cl2NO3
- Molmasse
- 222.03
Namen und Synonyme
1,3-dichloro-2-methoxy-5-nitrobenzene17742-69-7EC 403-350-6DTXSID00938930NSC 212118RefChem:414302DTXCID201367445403-350-6Benzene, 1,3-dichloro-2-methoxy-5-nitro-MFCD00061129NSC212118SCHEMBL2105879
Weitere Namen anzeigen
4-Nitro-2,6-dichloroanisole2,6-Dichloro-4-nitroanisole1,3-Dichloro-2-Methoxy-5-Nitro2,6-Dichloro-4-nitroanisole>2,6-DICHLORO-4-NITROANISOLE 99%2,6-Dichloro-4-nitroanisole, 98%3,5-Dichloro-4-methoxynitrobenzene2.6-Dichlor-4-nitro-1-Methoxy-benzol1,3-Dichloro-5-Methoxy-2-nitrobenzene
AKOS005600597NSC-2121181,3-dichloro-2-methoxy-5-nitro-benzeneD2872I10089AMY142882,6-Dichloro-4-nitrophenyl methyl etherA812256
Datenbank-Bezeichner
- CAS
17742-69-7- PubChem CID
- 309716
- DTXSID
DTXSID00938930- EC Number
- 403-350-6、605-800-9
- Nikkaji
- J82.671E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,2
- Polarare Oberfläche (TPSA)
- 55,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 185
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesDiamagnetic susceptibility
Physikochemische Eigenschaften
- Schmelzpunkt
- 97 · 97-100 °C
- Siedepunkt
- 305.6 · 305.6±37.0 °C(Predicted)
- Dichte
- 1.5223 · 1.5223 (rough estimate)
- Brechungsindex
- 1.614 · 1.6140 (estimate)
- Flammpunkt
- 160 °C · 160 °C
- storage temp.
- Sealed in dry,Room Temperature
- Löslichkeit
- DMSO (Sparingly), Chloroform (Slightly)
- Aggregatzustand
- Solid
- Farbe
- Pale Yellow to Yellow
- CAS Datenbank
- 17742 · 17742-69-7(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P273, P301+P316, P321, P330, P391, 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
Regulatory InformationStatus: Cease Manufacture Update: 16-08-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/4129
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Sicherheitsdaten
- ridadr
- 2811
- hs_code
- 29049095
- risk_code
- 51/53-25
- hazard_code
- N-T,T,N
- hazard_note
- Toxic
- safety_code
- 61-45-36/37
- hazard_class
- IRRITANT
- packing_group
- III
Chemie und Industrie
Anwendungen
Verwenden2,6-Dichloro-4-nitroanisole can be used for thyroid hormone receptor agonists.
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