1-Bromo-4-nitrobenzene CAS 586-78-7

Introduction：Basic information about 1-Bromo-4-nitrobenzene CAS 586-78-7, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

1-Bromo-4-nitrobenzene Basic information

• Product Name: 1-Bromo-4-nitrobenzene
• Synonyms: 1-BroMo-4-nitrobenzene, 99% 25GR;p-nitrobroMobenzene cation;The broMine nitrobenzene;p-Nitrobromobenzene;P-BROMONITROBENZENE;1-BROMO-4-NITROBENZENE;4-BROMONITROBENZENE;4-bromo-1-nitrobenzene
• CAS: 586-78-7
• MF: C6H4BrNO2
• MW: 202.01
• EINECS: 209-583-8
• Product Categories: Nitro Compounds;Nitrogen Compounds;Organic Building Blocks
• Mol File: 586-78-7.mol

1-Bromo-4-nitrobenzene Chemical Properties

• Melting point: 124-126 °C(lit.)
• Boiling point: 255-256 °C(lit.)
• density: 1,95 g/cm³
• refractive index: 1.6060 (estimate)
• Fp: 254-256°C
• storage temp.: Store below +30°C.
• solubility: soluble in Chloroform
• form: Crystalline Powder
• color: Light yellow
• Water Solubility: insoluble
• BRN: 636964
• InChI: 1S/C6H4BrNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H
• InChIKey: ZDFBKZUDCQQKAC-UHFFFAOYSA-N
• SMILES: [O-][N+](=O)c1ccc(Br)cc1
• CAS DataBase Reference: 586-78-7(CAS DataBase Reference)
• NIST Chemistry Reference: Benzene, 1-bromo-4-nitro-(586-78-7)
• EPA Substance Registry System: Benzene, 1-bromo-4-nitro- (586-78-7)

Safety Information

• Hazard Codes: Xn,Xi
• Risk Statements: 22-36/37/38-20/21/22-62-51/53-46-45
• Safety Statements: 36/37/39-26-22-61-53-45
• RIDADR: UN 3459 6.1/PG 3
• WGK Germany: 3
• RTECS: CY9040550
• TSCA: TSCA listed
• HazardClass: 6.1
• PackingGroup: III
• HS Code: 29049085
• Storage Class: 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects
• Hazard Classifications: Acute Tox. 4 Oral

1-Bromo-4-nitrobenzene Usage And Synthesis

Chemical Properties

light yellow powder

Uses

It can be employed as a syntheses material intermediate. It is also used as a pharmaceutical intermediate.

Synthesis Reference(s)

Tetrahedron, 43, p. 4321, 1987 DOI: 10.1016/S0040-4020(01)90307-2

Purification Methods

Crystallise it twice from pet ether, using charcoal before the first crystallisation. [Beilstein 5 III 619, 5 IV 729.]

1-Bromo-4-nitrobenzene Preparation Products And Raw materials

• Raw materials: Nitric acid-->Bromobenzene
• Preparation Products: 4-Nitrophenylboronic acid-->6-Bromoquinoline-->4-Bromophenoxybenzene-->NSC10978-->4-Nitroanisole-->4,4'-THIODIANILINE-->ethenylsulfanylethene-->4-bromo-2,6-dinitrophenol-->N,N-DIETHYL-4-NITROANILINE-->4-Nitrophenylboronic acid pinacol ester-->1-(4-Aminophenyl)-4-(4-hydroxyphenyl)piperazine-->2,7-Dibromophenazine-->4,4'-DINITROBIPHENYL-->Benzenamine, 4-(1-naphthalenyl)--->3-DIETHYLAMINO-1-NITROBENZENE-->1,2-Bis(4-bromophenyl)diazene