Grundinformationen
- Standard-SMILES
NNc1ccc([N+](=O)[O-])cc1- InChIKey
KMVPXBDOWDXXEN-UHFFFAOYSA-N- Summenformel
- C6H7N3O2
- Durchschnittliche Molmasse
- 153,14 g/mol
- Monoisotopische Masse
- 153,05382646
Überblick
4-Nitrophenylhydrazine is a orange-red leaflet or needles wetted with water. It will emit toxic oxides of nitrogen when heated to decomposition. It is slightly heavier than water and insoluble in water. It may be irritating to skin, eyes and mucous membranes. It may be toxic by ingestion. It may be explosive and sensitive to friction in the dry state. It is used as a reagent for ketones and aliphatic aldehydes.
Namen und Bezeichner
- Bevorzugter Name
- (4-Nitrophenyl)hydrazine
- IUPAC
- (4-nitrophenyl)hydrazine
- Lokaler Name
- 4-Nitrophenylhydrazin
- Englischer Name
- 4-Nitrophenylhydrazine
- Summenformel
- C6H7N3O2
- Molmasse
- 153.14
Namen und Synonyme
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Datenbank-Bezeichner
- CAS
100-16-3- PubChem CID
- 3310889
- DTXSID
DTXSID4059207- ChEBI
CHEBI:66931- UNII
- 2I8586432K
- EC Number
- 202-824-8
- Nikkaji
- J59.887I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,4
- Polarare Oberfläche (TPSA)
- 83,9 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 137
Experimentelle und physikochemische Eigenschaften
Physical Description
4-Nitrophenylhydrazine is a orange-red leaflet or needles wetted with water. It will emit toxic oxides of nitrogen when heated to decomposition. It is slightly heavier than water and insoluble in water. It may be irritating to skin, eyes and mucous membranes. It may be toxic by ingestion. It may be explosive and sensitive to friction in the dry state. It is used as a reagent for ketones and aliphatic aldehydes.
Orange-red solid; [Merck Index] Orange crystalline powder; [Alfa Aesar MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 156 °C · 156 °C (dec.)(lit.)
- Siedepunkt
- 276.04 °C · 276.04°C (rough estimate)
- Dichte
- 1 · 1.00
- Brechungsindex
- 1.691 · 1.6910 (estimate)
- storage temp.
- Explosives area
- pka
- 3.81 · 3.81±0.20(Predicted)
- Farbe
- Orange-red leaflets or needles
- Wasserlöslichkeit
- soluble in hot water
- Merck
- 14 · 14,6624
- BRN
- 608107 · 608107
- CAS Datenbank
- 100 · 100-16-3(CAS DataBase Reference)
- NIST chemische Informationen
- P-nitrophenyl hydrazine(100-16-3)
- EPA chemische Informationen
- Hydrazine, (4-nitrophenyl)- (100-16-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 2.4% (1 of 41) of reports.
Danger
H228 (95.1%): Flammable solid [Danger Flammable solids]
P210, P240, P241, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P403+P233, P405, 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. Each notification may be associated with multiple companies.
Not Classified
Gefahrenhinweise
Regulatory Information
Chemical: Hydrazine, (4-nitrophenyl)-
(4-Nitrophenyl)hydrazine: Does not have an individual approval but may be used under an appropriate group standard
Fire Hazards
Excerpt from ERG Guide 113 [Flammable Materials (Wet / Desensitized Explosive)]:
· Flammable/combustible material.
Health Hazards
Excerpt from ERG Guide 113 [Flammable Materials (Wet / Desensitized Explosive)]:
· Some are toxic and may be fatal if inhaled, ingested or absorbed through skin. Specifically, Dinitrophenol, wetted (UN1320); Dinitrophenolates, wetted (UN1321), Sodium dinitro-o-cresolate, wetted (UN1348); and Barium azide, wetted (UN1571) are known to be toxic.
Reactivity Profile
4-NITROPHENYLHYDRAZINE is a powerful explosive. It can SELF-IGNITE in the presence of contaminants. Auto-ignition temperature may vary for 4-nitrophenylhydrazine similar to that of hydrazine which has an autoignition of as low as 74oC in contact with iron rust. Dangerous fire hazard or severe explosion can occur when exposed to heat, flame or oxidizing agents. Severe explosion may also occur by chemical reaction with alkali metals; BaO; CaO; K; Na; NH3; Cl2; chromates; CuO; Cu++ salts; F2; H2O2; iron rust; metallic oxides; PbO2;Ni; Ni(ClO4)2; HNO3; N2O; O2; liquid O2; K2Cr2O7; Na2Cr2O7; tetryl; zinc diamide; Zn(C2H5)2. Dangerous; when heated to decomposition it emits highly toxic nitrogen compounds; may explode by heat or chemical reaction. (Sax and Lewis, 1987) under Hydrazine p. 538-539.
DOT Hazard Classification
4-Nitrophenylhydrazine, with not less than 30 percent water, by mass
UN3376
Div 4.1 Flammable solid (49 eCFR § 173.124)
PG I: the degree of danger presented by the material is great
Sicherheit und Schutzausrüstung
Accidental Release Measures
· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.
· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.
First Aid
Excerpt from ERG Guide 113 [Flammable Materials (Wet / Desensitized Explosive)]:
General First Aid:
Isolation and Evacuation
Excerpt from ERG Guide 113 [Flammable Materials (Wet / Desensitized Explosive)]:
Immediate precautionary measure
Sicherheitsdaten
- F
- 4.6
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3376 (4-NITROPHENYLHYDRAZINE, with not less than 30 % water, by mass)
- hs_code
- 29280000
- RTECS-Nr.
- MV8225000
- risk_code
- 5-11-22-36/37/38-43-21/22
- Toxizität
- mmo-sat 2 mmol/L AEMIDF 44,801,82
- hazard_code
- F,Xn
- hazard_note
- Flammable/Harmful
- safety_code
- 16-26-36/37/39-37/39-36
- hazard_class
- 4.1
- packing_group
- I
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
Verwenden4-Nitrophenylhydrazine is a nitro substituted aryl hydrazine with potential anticancer activity. Irritant.
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Ergänzende Hinweise
DefinitionChEBI: A member of the class of phenylhydrazines that is phenylhydrazine substituted at the 4-position by a nitro group.
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