4-chloro-2-(1H-imidazol-1-yl)pyrimidine

HCID 10607483

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Grundinformationen

CAS: 114834-04-7
Standard-SMILES: Clc1ccnc(-n2ccnc2)n1
InChIKey: DCQGLKJULMYXAV-UHFFFAOYSA-N
Summenformel: C7H5ClN4
Durchschnittliche Molmasse: 180,59 g/mol
Monoisotopische Masse: 180,0202739

Namen und Bezeichner

Bevorzugter Name: 4-chloro-2-(1H-imidazol-1-yl)pyrimidine
IUPAC: 4-chloro-2-imidazol-1-ylpyrimidine
Englischer Name: 4-chloro-2-(1H-imidazol-1-yl)pyrimidine
Summenformel: C7H5ClN4
Molmasse: 180.59

Namen und Synonyme

4-chloro-2-(1H-imidazol-1-yl)pyrimidine114834-04-7DTXSID00442380RefChem:98330DTXCID40393201890-723-54-chloro-2-imidazol-1-ylpyrimidineMFCD098319254-chloro-2-imidazolylpyrimidine2-(IMIDAZOL-1-YL)-4-CHLOROPYRIMIDINESCHEMBL5192586DCQGLKJULMYXAV-UHFFFAOYSA-N

Weitere Namen anzeigen

Pyrimidine, 4-chloro-2-(1H-imidazol-1-yl)-

PEA83404SBB0897274-chloro-2-(1-imidazolyl)pyrimidineAKOS006326841AB52667AS-8049CS-0335247EN300-7812018

Datenbank-Bezeichner

CAS: 114834-04-7
PubChem CID: 10607483
DTXSID: DTXSID00442380
EC Number: 890-723-5

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,2
Polarare Oberfläche (TPSA): 43,6 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 1
Schwere Atome: 12
Formalladung: 0
Komplexität: 154

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]；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, 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.