3-Amino-4-methoxypyridine

HCID 5200343CAS 33631-09-3

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Grundinformationen

Standard-SMILES: COc1ccncc1N
InChIKey: STWMPIWLSQKHSJ-UHFFFAOYSA-N
Summenformel: C6H8N2O
Durchschnittliche Molmasse: 124,14 g/mol
Monoisotopische Masse: 124,06366288

Namen und Bezeichner

Bevorzugter Name: 3-Amino-4-methoxypyridine
IUPAC: 4-methoxypyridin-3-amine
Englischer Name: 3-AMINO-4-METHOXYPYRIDINE
Summenformel: C6H8N2O
Molmasse: 124.14

Namen und Synonyme

3-AMINO-4-METHOXYPYRIDINE33631-09-3DTXSID30409446RefChem:276488DTXCID60360298640-774-24-methoxypyridin-3-amineMFCD073749594-METHOXY-3-PYRIDINAMINE3-amino-4methoxypryidine(4-Methoxypyridin-3-yl)amineEN300-61074

Weitere Namen anzeigen

CBI-BB ZERO/0048463-Amino-4-methoxypyridine ,98%3-AMINO-4-METHOXYPYRIDINE ISO 9001：2015 REACH

Z3593735283-PYRIDINAMINE, 4-METHOXY-4-Methoxy-pyridin-3-ylamine3-Amino4 methoxypyridine4-methoxy-3-pyridylamine3-Amino-4-methoxypyridinFT-06499853- Amino-4 methoxypyridine

Datenbank-Bezeichner

CAS: 33631-09-3
PubChem CID: 5200343
DTXSID: DTXSID30409446
EC Number: 640-774-2

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,1
Polarare Oberfläche (TPSA): 48,1 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 1
Schwere Atome: 9
Formalladung: 0
Komplexität: 87

Physikochemische Eigenschaften

Schmelzpunkt: 83 °C · 83 °C
Siedepunkt: 270.4 · 270.4±20.0 °C(Predicted)
Dichte: 1.139 · 1.139±0.06 g/cm3(Predicted)
storage temp.: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
Aggregatzustand: solid
pka: 7.48 · 7.48±0.18(Predicted)
Farbe: Brown
InChI: InChI=1S/C6H8N2O/c1-9-6-2-3-8-4-5(6)7/h2-4H,7H2,1H3
InChIKey: STWMPIWLSQKHSJ-UHFFFAOYSA-N
SMILES: C1=NC=CC(OC)=C1N

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (50%): Causes serious eye irritation [Warning 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+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+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.