2-Amino-4-chloropyrimidine-5-carbonitrile

HCID 71741379

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Grundinformationen

CAS: 1393179-35-5
Standard-SMILES: N#Cc1cnc(N)nc1Cl
InChIKey: UPUMETVQYQSNGW-UHFFFAOYSA-N
Summenformel: C5H3ClN4
Durchschnittliche Molmasse: 154,56 g/mol
Monoisotopische Masse: 154,0046238

Namen und Bezeichner

Bevorzugter Name: 2-Amino-4-chloropyrimidine-5-carbonitrile
IUPAC: 2-amino-4-chloropyrimidine-5-carbonitrile
Englischer Name: 2-AMino-4-chloro-pyriMidine-5-carbonitrile
Summenformel: C5H3ClN4
Molmasse: 154.56

Namen und Synonyme

2-amino-4-chloropyrimidine-5-carbonitrile1393179-35-52-AMino-4-chloro-pyriMidine-5-carbonitrileMFCD279231255-Pyrimidinecarbonitrile, 2-amino-4-chloro-2-amino-4-chloro-5-cyanopyrimidine2-amino-4-chloro-5-pyrimidinecarbonitrileSCHEMBL3356613DTXSID60857092UPUMETVQYQSNGW-UHFFFAOYSA-NEOS-60723AKOS022176190

Weitere Namen anzeigen

SB57669AS-65857SY024793DB-121986CS-0045829W16882F602182

Datenbank-Bezeichner

CAS: 1393179-35-5
PubChem CID: 71741379
DTXSID: DTXSID60857092
EC Number: 884-797-8

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,5
Polarare Oberfläche (TPSA): 75,6 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 0
Schwere Atome: 10
Formalladung: 0
Komplexität: 162

Physikochemische Eigenschaften

storage temp.: -20 °C, · -20°C, sealed storage, away from moisture and light

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): 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 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.