4-(Pyridin-2-yl)-1,3-thiazol-2-amine

HCID 1092459

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Grundinformationen

CAS: 30235-26-8
Standard-SMILES: Nc1nc(-c2ccccn2)cs1
InChIKey: BLKHMTAXNXLDJP-UHFFFAOYSA-N
Summenformel: C8H7N3S
Durchschnittliche Molmasse: 177,23 g/mol
Monoisotopische Masse: 177,03606841

Namen und Bezeichner

Bevorzugter Name: 4-(Pyridin-2-yl)-1,3-thiazol-2-amine
IUPAC: 4-pyridin-2-yl-1,3-thiazol-2-amine
Englischer Name: 4-Pyridin-2-yl-thiazol-2-ylamine
Summenformel: C8H7N3S
Molmasse: 177.23

Namen und Synonyme

4-(pyridin-2-yl)-1,3-thiazol-2-amineRefChem:516813673-114-730235-26-84-(Pyridin-2-yl)thiazol-2-amine4-Pyridin-2-yl-thiazol-2-ylamine2-Amino-4-(2-pyridyl)thiazole4-pyridin-2-yl-1,3-thiazol-2-amine2-THIAZOLAMINE, 4-(2-PYRIDINYL)-MFCD004604174-(2-PYRIDINYL)THIAZOL-2-AMINEOprea1_848403

Weitere Namen anzeigen

BUTTPARK 29\06-84TIMTEC-BB SBB010613IFLAB-BB F0447-02334-(2-pyridyl)-2-thiazolamine4-(2-Pyridinyl)-2-thiazolamine

4-(2-pyridinyl)-1,3-thiazol-2-amine4-(2-pyridyl)thiazol-2-amineSTK729294AC-258024-(2-pyridyl)(1,3-thiazol-2-yl)amineEN300-02253F0447-02334-(2-pyridyl)-1,3-thiazole-2-ylamine

Datenbank-Bezeichner

CAS: 30235-26-8
PubChem CID: 1092459
DTXSID: DTXSID20360239
ChEMBL: CHEMBL3104427
EC Number: 673-114-7
Nikkaji: J2.327.396I

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,2
Polarare Oberfläche (TPSA): 80 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 1
Schwere Atome: 12
Formalladung: 0
Komplexität: 153

Physikochemische Eigenschaften

Schmelzpunkt: 173 · 173-174 °C(Solv: ethanol, 50% (64-17-5))
Siedepunkt: 383.6 · 383.6±17.0 °C(Predicted)
Dichte: 1.333 · 1.333±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)
Aggregatzustand: Solid
pka: 3.4 · 3.40±0.10(Predicted)
Farbe: Pale brown

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (33.3%): 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 (33.3%): 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 3 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.