3-Bromonitrobenzene

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Company Name: Shaanxi Dideu Medichem Co. Ltd
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Products Intro: Product Name:3-Bromonitrobenzene
CAS:585-79-5
Purity:99.0% Package:100g;1kg;5kg;25kg Remarks:1066
Company Name: CD Chemical Group Limited
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Products Intro: CAS:585-79-5
Purity:0.99 Package:1000KG;100KG;5KG;1KG
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Products Intro: Product Name:4-Bromo-2-nitroaniline
CAS:585-79-5
Purity:0.99 Package:25KG
Company Name: XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.
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Products Intro: Product Name:1-Bromo-3-nitrobenzene
CAS:585-79-5
Purity:99.99% Package:25kg/drum
Company Name: Shanghai Xinchem
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Products Intro: Product Name:3-Bromonitrobenzene
CAS:585-79-5
Purity:98.5 Package:25/200 kg drums
3-Bromonitrobenzene Basic information
Product Name:3-Bromonitrobenzene
Synonyms:m-Nitrobromobenzene;1-bromo-3-nitro-benzen;1-Nitro-3-brombenzen;1-Nitro-3-bromobenzene;3-Bromo-1-nitrobenzene;Benzene,1-bromo-3-nitro-;BROMONITROBENZENE-3;M-BROMONITROBENZENE
CAS:585-79-5
MF:C6H4BrNO2
MW:202.01
EINECS:209-563-9
Product Categories:Quinolines;Aromatics;Aliphatics;Isotope Labelled Compounds;Nitro Compounds;Nitrogen Compounds;Organic Building Blocks;Aromatic Halides (substituted);Benzene derivates;Bromine Compounds;Nitro Compounds
Mol File:585-79-5.mol
3-Bromonitrobenzene Structure
3-Bromonitrobenzene Chemical Properties
Melting point 51-54 °C
Boiling point 256 °C
density 1.704
refractive index 1.6050 (estimate)
Fp 113 °C
storage temp. Refrigerator
solubility 10g/l
form Solid
color Off-White to Pale Yellow
BRN 2043212
Henry's Law Constant5.3×100 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
InChIInChI=1S/C6H4BrNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H
InChIKeyFWIROFMBWVMWLB-UHFFFAOYSA-N
SMILESC1(Br)=CC=CC([N+]([O-])=O)=C1
CAS DataBase Reference585-79-5(CAS DataBase Reference)
NIST Chemistry ReferenceBenzene, 1-bromo-3-nitro-(585-79-5)
EPA Substance Registry SystemBenzene, 1-bromo-3-nitro- (585-79-5)
Safety Information
Hazard Codes Xn,T,Xi
Risk Statements 36/37/38-20/21/22-33-23/24/25
Safety Statements 36/37/39-26-22-45-37-28A-28-37/39
RIDADR 2732
WGK Germany 3
RTECS CY9040500
Hazard Note Harmful
TSCA TSCA listed
HazardClass 6.1(b)
PackingGroup III
HS Code 29049090
Storage Class11 - Combustible Solids
MSDS Information
ProviderLanguage
ACROS English
3-Bromonitrobenzene Usage And Synthesis
Chemical Propertieswhite to light yellow crystal powder
UsesLabelled glycerol kinase substrate specificity
Synthesis Reference(s)The Journal of Organic Chemistry, 46, p. 2169, 1981 DOI: 10.1021/jo00323a039
Purification MethodsCrystallise it twice from pet ether, using charcoal before the first crystallisation. [Beilstein 5 III 618, 5 IV 729.]
Tag:3-Bromonitrobenzene(585-79-5) Related Product Information
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