3-Methoxypyridin

Pyridine, 3-methoxy- · 3-Methoxypyridine · beta-Methoxypyridine · 3-Methoxypyridine>3-Methoxypyridine 97% · 3-Methoxypyridine,97%

Identifikatoren & physikalische Daten

CAS No.	7295-76-3
Summenformel	C6H7NO
Durchschnittliche Molmasse	109,13 g/mol
Monoisotopische Masse	109,05276384 g/mol
SMILES	COc1cccnc1
InChIKey	UMJSCPRVCHMLSP-UHFFFAOYSA-N
PubChem CID	23719
EC No.	230-730-7
DTXSID	DTXSID60223238
Lokaler Name	3-Methoxypyridin

XLogP	1
Polarare Oberfläche (TPSA)	22,1
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	1
Schwere Atome	8
Formalladung	0
Komplexität	65,5
SpringerMaterials Properties	Diamagnetic susceptibility
Schmelzpunkt	203 °C
Siedepunkt	65 °C/15 mmHg (lit.)
Dichte	1.083 g/mL at 25 °C (lit.)
Brechungsindex	n20/D 1.518(lit.)
Flammpunkt	159 °F
Lagerbedingungen	Inert atmosphere,Room Temperature
Aggregatzustand	Liquid
pKa (Säurekonstante)	4.78(at 25℃)
Farbe	Clear colorless to slightly yellow
InChI	InChI=1S/C6H7NO/c1-8-6-3-2-4-7-5-6/h2-5H,1H3
InChIKey	UMJSCPRVCHMLSP-UHFFFAOYSA-N
SMILES	C1=NC=CC=C1OC
LogP (Verteilungskoeffizient)	0.990
NIST chemische Informationen	Pyridine, 3-methoxy-(7295-76-3)

GHS-Einstufung	WarningH315 (97.7%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Skin Irrit. 2 (97.7%)
Wassergefährdungsklasse (WGK)	3
Zollcode	29333999
R-Sätze (R)	36/37/38
Gefahrensymbole	Xi
Sicherheitshinweise (S)	26-36/37/39-36
Lagerklasse	10 - Combustible liquids
Gefahrenklasse	Eye Irrit. 2Skin Irrit. 2STOT SE 3

3-Methoxypyridine was used in the study of structure-activity relationships of pyridines as Sir2 histone/protein deacetylase inhibitors.