1-Iod-2-nitrobenzol

o-Iodonitrobenzene · 2-IODONITROBENZENE · O-NITROIODOBENZENE · 2-Iononitrobenzene · 2-NITRO IODO BENZENE · 2-Nitrophenyl iodide · 1-iodo-2-nitro-benzen · 2-Iodo-1-nitrobenzene

https://huagongshe.com/de/chemical/69115

Identifikatoren & physikalische Daten

CAS No.	609-73-4
Summenformel	C6H4INO2
Durchschnittliche Molmasse	249,01 g/mol
Monoisotopische Masse	248,92868 g/mol
SMILES	O=[N+]([O-])c1ccccc1I
InChIKey	JXMZUNPWVXQADG-UHFFFAOYSA-N
PubChem CID	69115
EC No.	210-200-1
DTXSID	DTXSID9060574
Lokaler Name	1-Iod-2-nitrobenzol

Chemische & physikalische Eigenschaften

XLogP	2,6
Polarare Oberfläche (TPSA)	45,8
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	0
Schwere Atome	10
Formalladung	0
Komplexität	134
Physical Description	Yellow powder[Alfa Aesar MSDS]
Kovats Retention Index	1457.8
Schmelzpunkt	49-51 °C(lit.)
Siedepunkt	288-289 °C(lit.)
Dichte	1.9186
Flammpunkt	>230 °F
Lagerbedingungen	Refrigerator (+4°C)
Löslichkeit	soluble in Methanolinsoluble
Aggregatzustand	Granular Powder
Farbe	Yellow-green to yellow-brown
BRN	2044110
Stabilität	Stable. Incompatible with strong bases, strong oxidizing agents.
InChI	1S/C6H4INO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H
InChIKey	JXMZUNPWVXQADG-UHFFFAOYSA-N
SMILES	[O-][N+](=O)c1ccccc1I
CAS Datenbank	609-73-4(CAS DataBase Reference)
NIST chemische Informationen	Benzene, 1-iodo-2-nitro-(609-73-4)
EPA chemische Informationen	Benzene, 1-iodo-2-nitro- (609-73-4)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (95.8%): Harmful if swallowed [Warning Acute toxicity, oral]H312 (95.8%): Harmful in contact with skin [Warning Acute toxicity, dermal]H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (97.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H332 (95.8%): Harmful if inhaled [Warning Acute toxicity, inhalation]H335 (95.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+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 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.
Gefahrenübersicht	A skin and strong eye irritantMay induce methemoglobinemiaToxic by ingestion and skin absorptionHarmful by inhalation[Alfa Aesar MSDS] See 2-Bromonitrobenzene.
Hazard Classes and Categories	Acute Tox. 4 (95.8%)Skin Irrit. 2 (97.9%)Eye Irrit. 2 (97.9%)STOT SE 3 (95.8%)
Unerwünschte Wirkungen	Methemoglobinemia - The presence of increased methemoglobin in the bloodthe compound is classified as secondary toxic effect
Wassergefährdungsklasse (WGK)	3
TSCA-Inventar-Status	TSCA listed
UN-Transportnummer	2811
Zollcode	29049090
R-Sätze (R)	20/21/22-36/37/38-36-33
Gefahrensymbole	Xn,Xi
Sicherheitshinweise (S)	26-36-36/37/39
Gefahrenklasse	IRRITANTAcute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Lagerklasse	11 - Combustible Solids

Anwendungen & Verwendung

Verwenden

1-Iodo-2-nitrobenzene is used as a reagent in the synthesis of 2'',4-Bis(aminophenyl)methane (B405515); an analog of 4,4''-Methylenedianiline (M304180) used in the manufacturing of resin enamel coating materials for copper wires.