Benzenamine, 4-methoxy-3-nitro-

3-NITRO-P-ANISIDINE · 4-METHOXY-3-NITROANI · 4-Methoxy-3-nitroaniline · 3-Nitro-p-anisidine (NH2=1) · 4-Methoxy-3-nitrobenzenamine · Benzenamine, 4-methoxy-3-nitro- · 3-Nitro-4-methoxybenzene-1-amine · 4-METHOXY-3-NITROANILINE ISO 9001：2015 REACH

https://huagongshe.com/de/chemical/123071

Molekülstruktur von Benzenamine, 4-methoxy-3-nitro-

Identifikatoren & physikalische Daten

CAS No.	577-72-0
Summenformel	C7H8N2O3
Durchschnittliche Molmasse	168,15 g/mol
Monoisotopische Masse	168,05349212 g/mol
SMILES	COc1ccc(N)cc1[N+](=O)[O-]
InChIKey	RUFOHZDEBFYQSV-UHFFFAOYSA-N
PubChem CID	123071
EC No.	684-537-1
DTXSID	DTXSID40206408

Chemische & physikalische Eigenschaften

XLogP	1,3
Polarare Oberfläche (TPSA)	81,1
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	4
Frei drehbare Bindungen	1
Schwere Atome	12
Formalladung	0
Komplexität	169
Schmelzpunkt	46-47 °C
Siedepunkt	356.9±22.0 °C(Predicted)
Dichte	1.318±0.06 g/cm3(Predicted)
Lagerbedingungen	under inert gas (nitrogen or Argon) at 2–8 °C
Löslichkeit	Acetonitrile (Slightly), Chloroform (Slightly)
Aggregatzustand	Solid
pKa (Säurekonstante)	3.33±0.10(Predicted)
Farbe	Dark Red
InChI	InChI=1S/C7H8N2O3/c1-12-7-3-2-5(8)4-6(7)9(10)11/h2-4H,8H2,1H3
InChIKey	RUFOHZDEBFYQSV-UHFFFAOYSA-N
SMILES	C1(N)=CC=C(OC)C([N+]([O-])=O)=C1
CAS Datenbank	577-72-0(CAS DataBase Reference)
NIST chemische Informationen	P-anisidine, 3-nitro-,(577-72-0)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH317 (95.1%): May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory.
Hazard Classes and Categories	Skin Sens. 1 (95.1%)
Zollcode	2922290090
Gefahrensymbole	Xi
hazard_note	Irritant

Anwendungen & Verwendung

Verwenden

4-Methoxy-3-nitroaniline is a chemical compound that has been shown to have anti-tumor and anti-inflammatory effects. It belongs to the class of amines and can be synthesized by nitrating 4-methoxy aniline.