2,4-Dichloro-6-methyl-5-nitropyrimidine
Grundinformationen
- CAS
13162-26-0- Standard-SMILES
Cc1nc(Cl)nc(Cl)c1[N+](=O)[O-]- InChIKey
NBCOZXBHPKSFSA-UHFFFAOYSA-N- Summenformel
- C5H3Cl2N3O2
- Durchschnittliche Molmasse
- 208 g/mol
- Monoisotopische Masse
- 206,9602317
Namen und Bezeichner
- Bevorzugter Name
- 2,4-Dichloro-6-methyl-5-nitropyrimidine
- IUPAC
- 2,4-dichloro-6-methyl-5-nitropyrimidine
- Englischer Name
- 2,4-Dichloro-6-methyl-5-nitropyrimidine
- Summenformel
- C5H3Cl2N3O2
- Molmasse
- 208
Namen und Synonyme
2,4-Dichloro-6-methyl-5-nitropyrimidinePyrimidine, 2,4-dichloro-6-methyl-5-nitro-DTXSID10298254RefChem:443363DTXCID00249391825-790-113162-26-02,4-Dichloro-5-nitro-6-methylpyrimidine2,4-Dichloro-6-methyl-5-nitro-pyrimidineMFCD000231962,6-dichloro-4-methyl-5-nitropyrimidineCS-D1701
Weitere Namen anzeigen
2,4-DicNSC 1220052,4-Dichloro-6-Methyl-5-NitroMethyl 2,6-Dichloro-5-nitropyriMidine2,4-dichlor-6-methyl-5-nitropyrimidin4-Dichloro-6-Methyl-5-nitro-pyriMidine2,4-dichloro-6-methyl-5-nitropyrimidin
2,4dichloro-6-methyl-5-nitropyrimidineAS-11858NSC122005AM20080229SCHEMBL56358CHEMBL162141GEO-03671SBB065677
Datenbank-Bezeichner
- CAS
13162-26-0- PubChem CID
- 275294
- DTXSID
DTXSID10298254- ChEMBL
CHEMBL162141- EC Number
- 825-790-1
- Nikkaji
- J742.777H
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 71,6 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 186
Physikochemische Eigenschaften
- Schmelzpunkt
- 52 · 52-54°C
- Siedepunkt
- 135 · 135-136 °C(Press: 22 Torr)
- Dichte
- 1.626 · 1.626±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Inert atmosphere,2-8°C
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- pka
- -5.3 · -5.30±0.39(Predicted)
- Aggregatzustand
- Solid
- Farbe
- Pale Yellow to Light Beige
- Stabilität
- Moisture Sensitive
- InChI
- InChI=1S/C5H3Cl2N3O2/c1-2-3(10(11)12)4(6)9-5(7)8-2/h1H3
- InChIKey
- NBCOZXBHPKSFSA-UHFFFAOYSA-N
- SMILES
- C1(Cl)=NC(C)=C([N+]([O-])=O)C(Cl)=N1
- CAS Datenbank
- 13162 · 13162-26-0(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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
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
Regulatory InformationPyrimidine, 2,4-dichloro-6-methyl-5-nitro-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Sicherheitsdaten
- hs_code
- 29335990
- risk_code
- 22-41-36/37/38
- hazard_code
- Xi,Xn
- safety_code
- 26-39-36/37/39
Chemie und Industrie
Anwendungen
VerwendenA synthetic intermediate
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter100 Anbieter
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