2,4-Dichloro-6-methyl-1,3,5-triazine

HCID 16083

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Grundinformationen

CAS: 1973-04-2
Standard-SMILES: Cc1nc(Cl)nc(Cl)n1
InChIKey: BFUGAHPTVMZLAC-UHFFFAOYSA-N
Summenformel: C4H3Cl2N3
Durchschnittliche Molmasse: 163,99 g/mol
Monoisotopische Masse: 162,9704025

Namen und Bezeichner

Bevorzugter Name: 2,4-Dichloro-6-methyl-1,3,5-triazine
IUPAC: 2,4-dichloro-6-methyl-1,3,5-triazine
Englischer Name: 2,4-Dichloro-6-methyl-1,3,5-triazine
Summenformel: C4H3Cl2N3
Molmasse: 163.99

Namen und Synonyme

2,4-dichloro-6-methyl-1,3,5-triazine1973-04-21,3,5-Triazine, 2,4-dichloro-6-methyl-DTXSID40274566RefChem:82357DTXCID70226038803-390-8BFUGAHPTVMZLAC-UHFFFAOYSA-NMFCD152036222,4-Dichloro-6-methyltriazineSCHEMBL94294AKOS006333573

Weitere Namen anzeigen

1,3,5-Triazine,2,4-dichloro-6-methyl-2,4-Dichloro-6-methyl-1,3,5-triazine1

SB734442,4-dichloro6-methyl-1,3,5-triazineBS-13160CS-0112249EN300-152890A9044252,4-Dichloro-6-methyl-1,3,5-tSY084711

Datenbank-Bezeichner

CAS: 1973-04-2
PubChem CID: 16083
DTXSID: DTXSID40274566
EC Number: 803-390-8
Nikkaji: J1.517.019K

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,3
Polarare Oberfläche (TPSA): 38,7 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 0
Schwere Atome: 9
Formalladung: 0
Komplexität: 89

Physikochemische Eigenschaften

Schmelzpunkt: 97 · 97-98 °C
Siedepunkt: 80 · 80-82 °C(Press: 12 Torr)
Dichte: 1.5 · 1.500±0.06 g/cm3(Predicted)
storage temp.: -20 °C · Sealed in dry,Store in freezer, under -20°C
pka: -0.71 · -0.71±0.10(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H330 (92.9%): Fatal if inhaled [Danger Acute toxicity, inhalation]

P260, P261, P264, P270, P271, P272, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P320, P321, P330, P333+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Corr. 1B (100%)；Skin Sens. 1 (100%)；Acute Tox. 2 (92.9%)

Sicherheitsdaten

wgk: 3
ridadr: UN 2923 6.1(8) / PGII
hs_code: 2933698090
risk_code: 14-22-26-34-43
hazard_code: T+,C
safety_code: 26-28-36/37/39-45
hazard_class: IRRITANT

Chemie und Industrie

Anwendungen

Verwenden2,4-Dichloro-6-methyltriazine is a reagent used to prepare triazinyl-amines as inhibitors of HIV-1 reverse transcriptase. It is also used in the synthesis of anilinotriazine corticotropin releasing hormone antagonists.