Grundinformationen
- CAS
147-82-0- Standard-SMILES
Nc1c(Br)cc(Br)cc1Br- InChIKey
GVPODVKBTHCGFU-UHFFFAOYSA-N- Summenformel
- C6H4Br3N
- Durchschnittliche Molmasse
- 329,81 g/mol
- Monoisotopische Masse
- 326,78938543
Überblick
structure in first source
Namen und Bezeichner
- Bevorzugter Name
- 2,4,6-Tribromoaniline
- IUPAC
- 2,4,6-tribromoaniline
- Lokaler Name
- 2,4,6-Tribromanilin
- Englischer Name
- 2,4,6-Tribromoaniline
- Summenformel
- C6H4Br3N
- Molmasse
- 329.81
Namen und Synonyme
2,4,6-TRIBROMOANILINE147-82-02,4,6-Tribromobenzenaminesym-TribromoanilineBenzenamine, 2,4,6-tribromo-Aniline tribromideUSAF DO-430C2N8WIL3BNSC-2216DTXSID5051733RefChem:442866DTXCID1030288
Weitere Namen anzeigen
4-Bromo-2-chloro-6-iodoanilineTribromoanisoleNSC 2216usafdo-43AKOS B028948TRIBROMOANILINEAKOS BBS-000035752,4,6-TribromoaniL
205-700-1s-Tribromoaniline2,4,6-TribromophenylamineAniline, 2,4,6-tribromo-2,4,6-TribomoanilineMFCD00007634BR121152628-37-2
Datenbank-Bezeichner
- CAS
147-82-0、52628-37-2- PubChem CID
- 8986
- DTXSID
DTXSID5051733- UNII
- 0C2N8WIL3B
- EC Number
- 205-700-1
- Nikkaji
- J5.840H
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,3
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 108
Experimentelle und physikochemische Eigenschaften
Chemical ClassesNitrogen Compounds -> Amines, Aromatic
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Density2.35
Color/FormNEEDLES FROM ALCOHOL, BENZENE
SolubilityINSOL IN WATER; SOL IN ALCOHOL, CHLOROFORM, ETHER
Boiling Point300 °C
DecompositionDISASTER HAZARD: SEE BROMIDES. WHEN STRONGLY HEATED, THEY EMIT HIGHLY TOXIC FUMES. /BROMIDES/
Melting Point120-122 °C
Physical DescriptionSolid; [Merck Index] White powder; [MSDSonline]
Physikochemische Eigenschaften
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
This chemical does not meet GHS hazard criteria for 17.9% (10 of 56) of reports.
Danger
H301 (71.4%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 56 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Benzenamine, 2,4,6-tribromo-
Benzenamine, 2,4,6-tribromo-: 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.
Hazards SummaryIntraperitoneal LD50 (mouse) = 500 mg/kg; [RTECS] Emergency treatment: Methemoglobinemia; [HSDB] An irritant; May induce methemoglobinemia; [MSDSonline]
Hazard Classes and CategoriesAcute Tox. 3 (71.4%)
Toxikologische Informationen
Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect
TSCA Test Submissions
The mutagenicity of 2,4,6-tribromoaniline was evaluated in Salmonella tester strains TA1535, TA1537, TA1538, TA98 and TA100 (Ames Test), and Saccharomyces cerevisiae strain D4, both in the presence and absence of metabolic activation by Aroclor-induced rat liver S9 fraction. Based on preliminary toxicity determinations, 2,4,6-tribromoaniline, diluted in DMSO, was tested at concentration up to 250ug/plate using the plate incorporation technique. 2,4,6-Tribromoaniline did not cause a positive response in any tester strain with or without metabolic activation.
Chemie und Industrie
Verwendung und Herstellung
Methods of ManufacturingBY CONTROLLED BROMINATION OF ANILINE: SUTHERS ET AL, J ORG CHEM 27, 447 (1962).
General Manufacturing InformationBenzenamine, 2,4,6-tribromo-: ACTIVE
Anwendungen
BeschreibungDas 2,4,6-Tribromanilin bildet farblose, in Wasser unlösliche Kristalle. Die Verbindung besitzt nur wissenschaftliches Interesse.
Verwenden2,4,6-Tribromoaniline was used in simultaneous determination of phenolic brominated flame retardants and their by-products in water.
Darstellung
synthetische2,4,6-Tribromoaniline can be prepared by treating bromine water with aniline in a solution of acetic acid or dilute hydrochloric acid:synthesis-of-2-4-6-tribromoaniline-from-aniline
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