4-(Pyridin-3-yl)aniline

HCID 459522CAS 82261-42-5

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Grundinformationen

Standard-SMILES: Nc1ccc(-c2cccnc2)cc1
InChIKey: DKFDPLVNPGJNDE-UHFFFAOYSA-N
Summenformel: C11H10N2
Durchschnittliche Molmasse: 170,21 g/mol
Monoisotopische Masse: 170,08439833

Namen und Bezeichner

Bevorzugter Name: 4-(Pyridin-3-yl)aniline
IUPAC: 4-pyridin-3-ylaniline
Englischer Name: 4-(3-Pyridyl)aniline
Summenformel: C11H10N2
Molmasse: 170.21

Namen und Synonyme

4-(pyridin-3-yl)anilineRefChem:516832674-609-04-pyridin-3-ylaniline82261-42-54-(3-Pyridyl)aniline4-pyridin-3-yl-phenylamine3-(4-aminophenyl)pyridineMFCD00956763Benzenamine, 4-(3-pyridinyl)-4-Pyridin-3-yl aniline4-Pyridin-3-ylphenylamine

Weitere Namen anzeigen

2-Pyridyl-4-aniline4-(3-Pyridyl)aminobenzene4-（3-pyridyl）benzeneamine4-(3-Pyridinyl)benzenamine

4-(3-pyridinyl)aniline4-(3-pyridyl)phenylamine3-(p-Aminophenyl)pyridine4-(pyridine-3-yl)aniline3-(4'-aminophenyl)pyridine3-(4-aminophenyl)-pyridine4-(Pyridin-3-yl)phenylamineSCHEMBL225149

Datenbank-Bezeichner

CAS: 82261-42-5
PubChem CID: 459522
DTXSID: DTXSID30332669
ChEBI: CHEBI:195076
EC Number: 674-609-0
Nikkaji: J35.831B

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 38,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 13
Formalladung: 0
Komplexität: 150

Physikochemische Eigenschaften

Schmelzpunkt: 115 °C · 115 °C
Siedepunkt: 333 ℃ · 333℃
Dichte: 1.133 · 1.133
Flammpunkt: 182 ℃ · 182℃
storage temp.: 2 · 2-8°C
Aggregatzustand: crystalline powder
pka: 5.54 · 5.54±0.10(Predicted)
Farbe: Yellow

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (50%): 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.