6-Methoxy-3-pyridylamin

6-Methoxy-3-pyridinylamine

HCID 81121CAS 6628-77-9

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Grundinformationen

Standard-SMILES: COc1ccc(N)cn1
InChIKey: UUVDJIWRSIJEBS-UHFFFAOYSA-N
Summenformel: C6H8N2O
Durchschnittliche Molmasse: 124,14 g/mol
Monoisotopische Masse: 124,06366288

Namen und Bezeichner

Bevorzugter Name: 6-Methoxy-3-pyridinylamine
IUPAC: 6-methoxypyridin-3-amine
Lokaler Name: 6-Methoxy-3-pyridylamin
Englischer Name: 5-Amino-2-methoxypyridine
Summenformel: C6H8N2O
Molmasse: 124.14

Namen und Synonyme

5-Amino-2-methoxypyridine6628-77-92-Methoxy-5-aminopyridine3-Pyridinamine, 6-methoxy-Pyridine, 5-amino-2-methoxy-6-Methoxy-3-pyridylamine6-methoxy-3-pyridinylamine6-METHOXY-3-PYRIDINAMINE6-methoxy-3-aminopyridineEINECS 229-612-8ATT39K5F0CNSC 59708

Weitere Namen anzeigen

6-METHOXYPYRIDIN-3-AMINE5-Amino-2-methoxy3-Amino-6-methoxypyOTAVA-BB BB70204100796-methoxy-3-pyridinamin6-methoxypyridin-3-amin2-Methoxypyridin-5-amine5-amino-2-methoxy-pyridin

BRN 01151553-AMINO-6-METHOXYPYRIDINENSC-59708DTXSID202164845-22-11-00408 (Beilstein Handbook Reference)(2-METHOXYPYRIDIN-5-YL)AMINERefChem:543653DTXCID20138975

Datenbank-Bezeichner

CAS: 6628-77-9
PubChem CID: 81121
DTXSID: DTXSID20216484
ChEBI: CHEBI:194950
UNII: ATT39K5F0C
EC Number: 229-612-8
Nikkaji: J265.561F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 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

Experimentelle und physikochemische Eigenschaften

Kovats Retention Index · 2 Einträge

1226

2165

Physikochemische Eigenschaften

Schmelzpunkt: 29 · 29-31 °C (lit.)
Siedepunkt: 85 · 85-90 °C/1 mmHg (lit.)
Dichte: 1.575 · 1.575
Brechungsindex: 20 · n20/D 1.575(lit.)
Flammpunkt: 230 °F · >230 °F
storage temp.: 2 · 2-8°C
Löslichkeit: Chloroform, Methanol (Slightly)
Aggregatzustand: Liquid
pka: 4.33 · 4.33±0.10(Predicted)
Farbe: Yellow-brown or red to very dark red
Wasserlöslichkeit: Slightly soluble
InChI: 1S/C6H8N2O/c1-9-6-3-2-5(7)4-8-6/h2-4H,7H2,1H3
InChIKey: UUVDJIWRSIJEBS-UHFFFAOYSA-N
SMILES: COc1ccc(N)cn1
CAS Datenbank: 6628 · 6628-77-9(CAS DataBase Reference)
NIST chemische Informationen: 5 · 5-Amino-2-methoxypyridine(6628-77-9)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): 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]；H335 (97.9%): 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, 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 48 reports by companies from 7 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.