Pyridine-4-amidine hydrochloride

HCID 2776844CAS 42518-06-9

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Grundinformationen

Standard-SMILES: Cl.N=C(N)c1ccncc1
InChIKey: IONKMFGAXKCLMI-UHFFFAOYSA-N
Summenformel: C6H8ClN3
Durchschnittliche Molmasse: 157,6 g/mol
Monoisotopische Masse: 157,040675

Namen und Bezeichner

Bevorzugter Name: Pyridine-4-amidine hydrochloride
IUPAC: pyridine-4-carboximidamide;hydrochloride
Englischer Name: 4-Amidinopyridinium chloride
Summenformel: C6H8ClN3
Molmasse: 157.6

Namen und Synonyme

42518-06-9RefChem:870749Pyridine-4-amidine hydrochloride692-231-4Isonicotinimidamide hydrochloride6345-27-3Pyridine-4-carboximidamide Hydrochloride4-Amidinopyridine hydrochloride4-AMIDINOPYRIDINIUM CHLORIDEIsonicotinamidine hydrochlorideMFCD00040385pyridine-4-carboxamidine hydrochloride

Weitere Namen anzeigen

BUTTPARK 32\03-564-methylamidinopyridine chloride4-AMIDINOPYRIDINIUM HYDROCHLORIDEPYRIDINE-4-CARBOXIMIDAMIDE HYDRATE HCL4-PYRIDINECARBOXIMIDAMIDE, HYDROCHLORIDE

4-pyridinecarboximidamide hydrochloride4-AMIDINOPYRIDINE HYDROCHLORIDEPYRIDINE-4-CARBOXIMIDAMIDE HYDROCHLORIDEpyridine-4-carboximidamide;hydrochlorideIsonicotinimidamide xhydrochloride4-Pyridinecarboximidamide, monohydrochlorideIsonicotinimidamide hydrochloride(1:x)SCHEMBL444468pyridine-4-carboximidamide HCl

Datenbank-Bezeichner

CAS: 42518-06-9、6345-27-3
PubChem CID: 2776844
EC Number: 692-231-4

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 62,8 Å²
H-Brücken-Donoren: 3
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 10
Formalladung: 0
Komplexität: 105

Physikochemische Eigenschaften

Schmelzpunkt: 263 °C · 263 °C
storage temp.: Inert atmosphere,Room Temperature
InChI: InChI=1S/C6H7N3.ClH/c7-6(8)5-1-3-9-4-2-5;/h1-4H,(H3,7,8);1H
InChIKey: IONKMFGAXKCLMI-UHFFFAOYSA-N
SMILES: C(C1=CC=NC=C1)(N)=N.Cl

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]；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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.