100-11-8

Directory

Identification

Chemical Properties

Safety Data

Raw materials And Preparation Products

Material Safety Data Sheet(MSDS)

Hazard Information

Spectrum Detail

Well-known Reagent Company Product Information

suppliers list

100-11-8 Structure

Identification	More
[Name] 4-Nitrobenzyl bromide
[CAS] 100-11-8
[Synonyms] 1-(BROMOMETHYL)-4-NITROBENZENE 4NBB 4-NITROBENZYL BROMIDE a-Brom-4-nitrotoluol A-BROMO-P-NITROTOLUENE AKOS BBS-00004545 ALPHA-BROMO-4-NITROTOLUENE ALPHA-BROMO-P-NITROTOLUENE NITROBENZYL-4 BROMIDE PARA NITRO BENZYL BROMIDE P-NITROBENZYL BROMIDE 1-(bromomethyl)-4-nitro-benzen 4-(bromomethyl)nitrobenzene alpha-Bromoparanitrotoluene alpha-bromo-p-nitro-toluen -Bromo-4-nitro-toluene Nitrobenzyl bromide p-(Bromomethyl)nitrobenzene p-Nitobenzylbromide Toluene, alpha-bromo-4-nitro-
[EINECS(EC#)] 202-820-6
[Molecular Formula] C7H6BrNO2
[MDL Number] MFCD00007373
[Molecular Weight] 216.03
[MOL File] 100-11-8.mol

Chemical Properties	Back Directory
[Appearance] white to light yellow crystal powde
[Melting point ] 98 °C
[Boiling point ] 265.51°C (rough estimate)
[density ] 1.6841 (rough estimate)
[refractive index ] 1.6120 (estimate)
[storage temp. ] Store at RT.
[solubility ] soluble in Chloroform, Ethyl Acetate
[form ] Crystalline Powder
[color ] Light yellow to beige
[Stability:] Stable. Incomaptible with bases, amines, oxidizing agents, alcohols. May be moisture sensitive. Corrodes steel.
[Water Solubility ] It hydrolyzes in water. Soluble in alcohol and ether.
[BRN ] 742796
[InChI] InChI=1S/C7H6BrNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2
[InChIKey] VOLRSQPSJGXRNJ-UHFFFAOYSA-N
[SMILES] C1(CBr)=CC=C([N+]([O-])=O)C=C1
[CAS DataBase Reference] 100-11-8(CAS DataBase Reference)
[NIST Chemistry Reference] Benzene, 1-(bromomethyl)-4-nitro-(100-11-8)
[EPA Substance Registry System] 100-11-8(EPA Substance)

Safety Data	Back Directory
[Hazard Codes ] C,Xi
[Risk Statements ] R34:Causes burns.
[Safety Statements ] S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ] UN 3261 8/PG 2
[WGK Germany ] 3
[RTECS ] XS7967000
[F ] 10-19-21
[Hazard Note ] Irritant/Corrosive
[TSCA ] Yes
[HazardClass ] 8
[PackingGroup ] II
[HS Code ] 29049085

Raw materials And Preparation Products	Back Directory
[Raw materials] 4-Nitrotoluene
[Preparation Products] FLUCYCLOXURON-->4-(Morpholinomethyl)aniline-->DIETHYL(4-NITROBENZYL)PHOSPHONATE-->2-Nitro-3-pyridinamine-->N,N-DIBENZYL GLYCINE METHYL ESTER-->1-(4-Nitrophenyl)methyl-1,2,4-triazole-->(4-Nitrophenyl)methanesulfonyl chloride-->4-Aminobenzylamine-->4-AMINO-N,N-DIMETHYLBENZYLAMINE

Material Safety Data Sheet(MSDS)	Back Directory
[msds information] a-Brom-4-nitrotoluol(100-11-8).msds

Hazard Information	Back Directory
[Chemical Properties] white to light yellow crystal powde
[Uses] 4-Nitrobenzyl bromide is used in the synthesis of di and tri-substituted azoles. It is also used in the preparation of N6-Benzyladenosine-5?-uronamides as selective A3 adenosine agonists.
[Definition] ChEBI: A C-nitro compound that consists of nitrobenzene bearing a bromomethyl substituent at the para-position.
[Purification Methods] Recrystallise the bromide four times from absolute EtOH, then twice from cyclohexane/hexane/*benzene (1:1:1), followed by sublimation at 0.1mm and final recrystallisation from the same solvent mixture. [Lichtin & Rao J Am Chem Soc 83 2417 1961.] It has also been crystallised from pet ether (b 80-100o, 10mL/g, charcoal). It slowly decomposes even when stored in a desiccator in the dark. IRRITANT. [Beilstein 5 IV 861.]

Spectrum Detail	Back Directory
[Spectrum Detail] 4-Nitrobenzyl bromide(100-11-8)MS 4-Nitrobenzyl bromide(100-11-8)¹HNMR 4-Nitrobenzyl bromide(100-11-8)¹³CNMR 4-Nitrobenzyl bromide(100-11-8)IR1 4-Nitrobenzyl bromide(100-11-8)IR2 4-Nitrobenzyl bromide(100-11-8)Raman

Tags:100-11-8 Related Product Information

98-74-8 4457-32-3 100-02-7 99-99-0 7789-38-0 119302-91-9 61312-84-3 518-67-2 100-39-0 50700-72-6 17201-43-3 62-23-7 619-72-7 619-73-8 106-95-6 1239-45-8 100-14-1 122-04-3

HomePage | Member Companies | Advertising | Contact us | Previous WebSite | MSDS | CAS Index | CAS DataBase | Privacy | Terms | About Us
All products displayed on this website are only for non-medical purposes such as industrial applications or scientific research, and cannot be used for clinical diagnosis or treatment of humans or animals. They are not medicinal or edible.
According to relevant laws and regulations and the regulations of this website, units or individuals who purchase hazardous materials should obtain valid qualifications and qualification conditions.

100-11-8

Login

Fast registration