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2-Nitro-N-phenylanilin

2-Nitrodiphenylamine

HCID 8407
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Grundinformationen

CAS
119-75-5
Standard-SMILES
O=[N+]([O-])c1ccccc1Nc1ccccc1
InChIKey
RUKISNQKOIKZGT-UHFFFAOYSA-N
Summenformel
C12H10N2O2
Durchschnittliche Molmasse
214,22 g/mol
Monoisotopische Masse
214,07422756

Überblick

2-nitrodiphenylamine appears as red-brown crystalline powder or reddish-brown solid. (NTP, 1992)

Namen und Bezeichner

Bevorzugter Name
2-Nitrodiphenylamine
IUPAC
2-nitro-N-phenylaniline
Lokaler Name
2-Nitro-N-phenylanilin
Englischer Name
2-Nitrodiphenylamine
Summenformel
C12H10N2O2
Molmasse
214.22

Namen und Synonyme

2-Nitrodiphenylamine119-75-52-Nitro-N-phenylanilineBenzenamine, 2-nitro-N-phenyl-o-(Phenylamino)nitrobenzeneCCRIS 6075DTXSID4025749EINECS 204-348-6N-Phenyl-2-nitrobenzenamineAI3-08882DTXCID7057492-nitro-n-phenylbenzeneamine
Weitere Namen anzeigen
NitrodiphenylamineO-NITRO DIPHENYLAMINENSC 4754NSC 629274NSC 105613c.i. 10335Sudan Yellow 1339TIMTEC-BB SBB000544
PHENYL 2-NITROPHENYLAMINEoNitrodiphenylaminePHENYL(2-NITROPHENYL)AMINENPhenylonitroanilineoNitroNphenylaniline2NitroNphenylanilineDiphenylamine, 2nitroRefChem:88722

Datenbank-Bezeichner

CAS
119-75-5
PubChem CID
8407
DTXSID
DTXSID4025749
ChEMBL
CHEMBL1450018

Eigenschaften

Berechnete StruktureigenschaftenWird ergänzt

XLogP
3,7
Polarare Oberfläche (TPSA)
57,9 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
2
Schwere Atome
16
Formalladung
0
Komplexität
234

Experimentelle und physikochemische Eigenschaften

Chemical ClassesNitrogen Compounds -> Nitroanilines
SpringerMaterials PropertiesBoiling point
Density1.36 @25 °C
Solubility · 2 Einträge

less than 1 mg/mL at 72 °F (NTP, 1992)

1.1 [ug/mL] (The mean of the results at pH 7.4)

Melting Point · 2 Einträge

167.9 °F (NTP, 1992)

75.5 °C

Physical Description · 3 Einträge

2-nitrodiphenylamine appears as red-brown crystalline powder or reddish-brown solid. (NTP, 1992)

CBI; Liquid

Orange solid; [Reference #1] Reddish-brown solid; [CAMEO] Red or orange crystalline solid; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
74 · 74-76 °C(lit.)
Siedepunkt
346 °C · 346 °C

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (100%): 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 60 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Benzenamine, 2-nitro-N-phenyl-

Benzenamine, 2-nitro-N-phenyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, 2-nitro-N-phenyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Benzenamine, 2-nitro-N-phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

DOT LabelPoison
Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this chemical include irritation of the skin, eyes, mucous membranes and upper respiratory tract. Structurally similar chemicals may cause methemoglobinemia.
Hazards SummaryA skin, eye, mucous membrane, and upper respiratory tract irritant; May cause methemoglobinemia, based on structurally similar compounds; [NTP] A skin and strong eye irritant; [Alfa Aesar MSDS] See Otto fuel.

Chemie und Industrie

Verwendung und Herstellung

Uses · 1 Eintrag

Used to control the combustion of propylene glycol dinitrate in Otto fuel II (US navy propellant for torpedoes and other weapons systems); Also used as a solvent dye; [ATSDR Public Health Statements] Used as stabilizer for nitroglycerin and as a chemical intermediate; [NTP]

U.S. Production2023: <75,000 lb
Industry UsesOther
General Manufacturing Information · 2 Einträge

All Other Chemical Product and Preparation Manufacturing

Benzenamine, 2-nitro-N-phenyl-: ACTIVE

Anwendungen · 2 Einträge

Verwenden(2-Nitrophenyl)phenylamine (cas# 119-75-5) is a compound useful in organic synthesis.

Verwenden2-Nitrodiphenylamine is used to control the combustion of propylene glycol dinitrate in Otto fuel II (US navy propellant for torpedoes and other weapons systems); Also used as a solvent dye; Used as stabilizer for nitroglycerin and as a chemical intermediate

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

Natriumacetat1-Chlor-2-nitrobenzol1-nitro-2-nitrosobenzene1-Brom-2-nitrobenzol2-Nitrophenylboronic acid1-Iod-2-nitrobenzol

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UNII
DT9NA7ZDD8
EC Number
204-348-6
Nikkaji
J37.804F
Dichte
1.36 · 1.36
Dampfdichte
10.7 · 10.7 (vs air)
Brechungsindex
1.666 · 1.6660 (estimate)
Flammpunkt
346 °C · 346°C
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
Löslichkeit
Chloroform (Slightly), , DMSO (Slightly), Methanol (Slightly, Sonicated)
Aggregatzustand
Solid
pka
-3.39 · -3.39±0.20(Predicted)
Farbe
Red
Wasserlöslichkeit
negligible
BRN
2213591 · 2213591
InChIKey
RUKISNQKOIKZGT-UHFFFAOYSA-N
CAS Datenbank
119 · 119-75-5(CAS DataBase Reference)
NIST chemische Informationen
2 · Benzenamine, 2-nitro-N-phenyl-(119-75-5)
EPA chemische Informationen
2 · 2-Nitrodiphenylamine (119-75-5)
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile2-NITRODIPHENYLAMINE is incompatible with strong oxidizers, strong acids and strong bases. (NTP, 1992)
Air and Water ReactionsThis chemical may be sensitive to prolonged exposure to air. Insoluble in water.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheit und Schutzausrüstung

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. A water spray may also be used. (NTP, 1992)
First Aid · 1 Eintrag

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 Eintrag

SMALL SPILLS AND LEAKAGE: If a spill of this chemical occurs, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with acetone and transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Protective Action Criteria (PAC) · 3 Einträge

12 [mg/m3]

130 [mg/m3]

790 [mg/m3]

Personal Protective Equipment (PPE) · 1 Eintrag

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Toxikologische Informationen

Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect
EPA Provisional Peer-Reviewed Toxicity Values · 3 Einträge

2-Nitrodiphenylamine

PDF Document

2011

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29214400
risk_code
36/37/38
hazard_code
Xi
hazard_note
Irritant
safety_code
26-36-37/39
Benzolboronsäure
Anilin

Nachgelagerte Produkte

N-Phenyl-o-phenylendiamin4-Nitro-N-phenylanilin1-Phenyl-2-(2-fluophenyl)benzimidazole