6-Chloropyrimidine-2,4,5-triamine

HCID 500505CAS 1194-78-1

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Grundinformationen

Standard-SMILES: Nc1nc(N)c(N)c(Cl)n1
InChIKey: BMCHNFZLERXZBI-UHFFFAOYSA-N
Summenformel: C4H6ClN5
Durchschnittliche Molmasse: 159,58 g/mol
Monoisotopische Masse: 159,0311729

Namen und Bezeichner

Bevorzugter Name: 6-Chloropyrimidine-2,4,5-triamine
IUPAC: 6-chloropyrimidine-2,4,5-triamine
Englischer Name: 2,4,5-Triamino-6-chloropyrimidine
Summenformel: C4H6ClN5
Molmasse: 159.58

Namen und Synonyme

6-chloropyrimidine-2,4,5-triamine1194-78-1DTXSID10333331RefChem:308149DTXCID202844212,4,5-Pyrimidinetriamine, 6-chloro-2,4,5-TRIAMINO-6-CHLOROPYRIMIDINEMFCD111144486-chloro-2,4,5-PyrimidinetriamineSCHEMBL1512060SCHEMBL29419387BMCHNFZLERXZBI-UHFFFAOYSA-N

Weitere Namen anzeigen

2,4,5-Triamino-6-chloropyrimid2,4,5-Triamio-6-chloropyrimidine2,4,5-Triamino-6-hydroxypyrimidine dihydrochloride

AKOS006305893SB57688DS-11134SY114221DB-061569CS-0106539C71642EN300-1273031

Datenbank-Bezeichner

CAS: 1194-78-1
PubChem CID: 500505
DTXSID: DTXSID10333331
EC Number: 982-227-3

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -0,2
Polarare Oberfläche (TPSA): 104 Å²
H-Brücken-Donoren: 3
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 0
Schwere Atome: 10
Formalladung: 0
Komplexität: 120

Physikochemische Eigenschaften

storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；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, P317, 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 2 reports by companies from 1 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.