4,6-Dichloro-1,3,5-trazin-2-amine
Grundinformationen
- CAS
933-20-0- Standard-SMILES
Nc1nc(Cl)nc(Cl)n1- InChIKey
MCLXKFUCPVGZEN-UHFFFAOYSA-N- Summenformel
- C3H2Cl2N4
- Durchschnittliche Molmasse
- 164,98 g/mol
- Monoisotopische Masse
- 163,96565142
Namen und Bezeichner
- Bevorzugter Name
- 4,6-Dichloro-1,3,5-trazin-2-amine
- IUPAC
- 4,6-dichloro-1,3,5-triazin-2-amine
- Englischer Name
- 2-Amino-4,6-dichlorotriazine
- Summenformel
- C3H2Cl2N4
- Molmasse
- 164.98
Namen und Synonyme
933-20-02-Amino-4,6-dichlorotriazine2-Amino-4,6-dichloro-1,3,5-triazine2-AMINO-4,6-DICHLORO-S-TRIAZINE4,6-Dichloro-1,3,5-trazin-2-amineNSC 71988UNII-T5S5IYO89GT5S5IYO89GNSC 267458BRN 01242662,4-Dichloro-6-amino-1,3,5-triazineAI3-51037
Weitere Namen anzeigen
dichloro-1,3,5-triazin-2-amineAMino-dichloro-1,3,5-triazine2-amino-4,6-dichloro-s-triazin
2,4-dichloro-6-amino-s-triazineNSC-71988NSC-267458S-DICHLOROAMINOTRIAZINEAMINODICHLORO-S-TRIAZINEDTXSID402393724,6-dichloro-2-amino-s-triazine5-26-08-00011 (Beilstein Handbook Reference)
Datenbank-Bezeichner
- CAS
933-20-0- PubChem CID
- 13615
- DTXSID
DTXSID40239372- UNII
- T5S5IYO89G
- EC Number
- 625-682-2
- Nikkaji
- J32.979G
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,5
- Polarare Oberfläche (TPSA)
- 64,7 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 89,8
Physikochemische Eigenschaften
- Schmelzpunkt
- 239 · 239-242°C
- Siedepunkt
- 428.8 · 428.8±28.0 °C(Predicted)
- Dichte
- 1.731 · 1.731±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Löslichkeit
- DMSO, Methanol (Sparingly)
- Aggregatzustand
- Solid
- pka
- 2.28 · 2.28±0.10(Predicted)
- Farbe
- White to Off-White
- BRN
- 124266 · 124266
- Stabilität
- Stable at RT
- InChI
- InChI=1S/C3H2Cl2N4/c4-1-7-2(5)9-3(6)8-1/h(H2,6,7,8,9)
- InChIKey
- MCLXKFUCPVGZEN-UHFFFAOYSA-N
- SMILES
- N1=C(Cl)N=C(Cl)N=C1N
- CAS Datenbank
- 933 · 933-20-0(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (95.3%): 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)
Aggregated GHS information provided per 43 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (95.3%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2933698090
- RTECS-Nr.
- XY3177000
- risk_code
- 20/21/22-36/37/38-22
- hazard_code
- Xn
- safety_code
- 23-36/37/39-26
- hazard_class
- IRRITANT
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
VerwendenAn aromatic intermediate compound, 2-Amino-4,6-dichlorotriazine can be useful for the preparation of substituted melamine, ammelides, and ammelines.
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