ChemicalBook--->CAS DataBase List--->3958-57-4

3958-57-4

3958-57-4 Structure

3958-57-4 Structure
IdentificationMore
[Name]

3-Nitrobenzyl bromide
[CAS]

3958-57-4
[Synonyms]

3-NITROBENZYL BROMIDE
A-BROMO-M-NITROTOLUENE
ALPHA-BROMO-3-NITROTOLUENE
ALPHA-BROMO-M-NITROTOLUENE
M-NITROBENZYL BROMIDE
1-(bromomethyl)-3-nitro-benzen
1-(Bromomethyl)-3-nitrobenzene
m-(Bromomethyl)nitrobenzene
m-Nitro-alpha-bromotoluene
Toluene, alpha-bromo-m-nitro-
a-Bromo-3-nitrotoluene
3-Nitrobenzyl bromide, 98+%
à-bromo-3-nitrotoluene
α-bromo-m-nitrotoluene
3-(Bromomethyl)nitrobenzene
m-Nitro-a-bromotoluene
3-Nitro-1-(bromomethyl)benzene
α-Bromo-3-nitrotoluene
[EINECS(EC#)]

223-557-3
[Molecular Formula]

C7H6BrNO2
[MDL Number]

MFCD00007271
[Molecular Weight]

216.03
[MOL File]

3958-57-4.mol
Chemical PropertiesBack Directory
[Appearance]

Pale Yellow Crystalline Solid
[Melting point ]

58-59 °C(lit.)
[Boiling point ]

153-154 °C (7 mmHg)
[density ]

1.6841 (rough estimate)
[refractive index ]

1.6120 (estimate)
[Fp ]

153-154°C/7mm
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

Dichloromethane, Hot Ethanol
[form ]

Crystalline Powder or Crystals
[color ]

Yellow to light brown
[Water Solubility ]

insoluble
[Detection Methods]

HPLC,NMR
[BRN ]

742795
[InChIKey]

LNWXALCHPJANMJ-UHFFFAOYSA-N
[CAS DataBase Reference]

3958-57-4(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzene, 1-(bromomethyl)-3-nitro-(3958-57-4)
[EPA Substance Registry System]

3958-57-4(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
R36/37:Irritating to eyes and respiratory system .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S27:Take off immediately all contaminated clothing .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
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
[TSCA ]

Yes
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29049090
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Carbon tetrachloride-->N-Bromosuccinimide-->Benzoyl peroxide-->3-Nitrotoluene
[Preparation Products]

3-NITROPHENYLACETIC ACID-->3-NITROBENZYLAMINE-->Benzenemethanamine, N-butyl-3-nitro--->(3-NITROPHENYL)ACETIC ACID METHYL ESTER-->3-AMINO-N,N-DIMETHYLBENZYLAMINE-->Benzenemethanamine, N-(1,1-dimethylethyl)-3-nitro--->[1-(4-NITRO-BENZYL)-PIPERIDIN-4-YL]-CARBAMIC ACID TERT-BUTYL ESTER-->3-(4-fluorophenoxymethyl)aniline-->1-[4-[(3-aminophenyl)methyl]-1-piperazinyl]ethanone-->Ethyl-(3-nitro-benzyl)-aMine
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Nitrobenzyl bromide(3958-57-4).msds
Hazard InformationBack Directory
[Chemical Properties]

Pale Yellow Crystalline Solid
[Uses]

3-Nitrobenzyl bromide was used in the synthesis of 1,4-disubstituted imidazoles.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Nitrobenzyl bromide(3958-57-4)MS
3-Nitrobenzyl bromide(3958-57-4)1HNMR
3-Nitrobenzyl bromide(3958-57-4)13CNMR
3-Nitrobenzyl bromide(3958-57-4)IR1
3-Nitrobenzyl bromide(3958-57-4)IR2
3-Nitrobenzyl bromide(3958-57-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Nitrobenzyl bromide, 99%(3958-57-4)
[Alfa Aesar]

3-Nitrobenzyl bromide, 98+%(3958-57-4)
[Sigma Aldrich]

3958-57-4(sigmaaldrich)
[TCI AMERICA]

3-Nitrobenzyl Bromide,>98.0%(GC)(3958-57-4)
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