(2-Methoxypyridin-4-yl)methanamine

HCID 16227983CAS 148900-69-0

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Grundinformationen

Standard-SMILES: COc1cc(CN)ccn1
InChIKey: UQAHBOKPZNLKRF-UHFFFAOYSA-N
Summenformel: C7H10N2O
Durchschnittliche Molmasse: 138,17 g/mol
Monoisotopische Masse: 138,07931295

Namen und Bezeichner

Bevorzugter Name: (2-Methoxypyridin-4-yl)methanamine
IUPAC: (2-methoxy-4-pyridinyl)methanamine
Englischer Name: 4-Pyridinemethanamine,2-methoxy-(9CI)
Summenformel: C7H10N2O
Molmasse: 138.17

Namen und Synonyme

(2-methoxypyridin-4-yl)methanamineRefChem:396025826-895-5148900-69-04-PYRIDINEMETHANAMINE, 2-METHOXY-(2-METHOXY-4-PYRIDYL)METHANAMINE(2-methoxypyridin-4-yl)methylamineMFCD090546794-(Aminomethyl)-2-methoxypyridine4-Pyridinemethanamine,2-methoxy-(9CI)1-(2-METHOXYPYRIDIN-4-YL)METHANAMINE4-AMINOMETHYL-2-METHOXYPYRIDINE

Weitere Namen anzeigen

(2-Methoxypyridin-4-yl)4-Aminomethyl-2-methoxypy...2-Methoxy-4-PyridineMethanaMine

CHEMBL4066086(2-methoxy-4-pyridinyl)methanamine2-Methoxy-4-pyridinemethylamineC-(2-Methoxy-pyridin-4-yl)-methylamineSCHEMBL4492002-methoxy4-aminomethylpyridineF2147-1549DTXSID40585482

Datenbank-Bezeichner

CAS: 148900-69-0
PubChem CID: 16227983
DTXSID: DTXSID40585482
ChEMBL: CHEMBL4066086
EC Number: 826-895-5

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0
Polarare Oberfläche (TPSA): 48,1 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 2
Schwere Atome: 10
Formalladung: 0
Komplexität: 97

Physikochemische Eigenschaften

Siedepunkt: 240.6 · 240.6±25.0 °C(Predicted)
Dichte: 1.09 · 1.090±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)
pka: 7.41 · 7.41±0.29(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]；H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 3 (50%)；Acute Tox. 4 (50%)；Acute Tox. 4 (50%)；Skin Irrit. 2 (50%)；Eye Dam. 1 (50%)；Acute Tox. 4 (50%)；STOT SE 3 (50%)