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107794

2-Nitrobenzyl bromide

98%

Synonym(s):

α-Bromo-2-nitrotoluene

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About This Item

Linear Formula:
O2NC6H4CH2Br
CAS Number:
3958-60-9
Molecular Weight:
216.03
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24846780
EC Number:
223-558-9
Beilstein/REAXYS Number:
638991
MDL number:
MFCD00007184
Assay:
98%
Form:
solid
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Quality Segment

100

assay

98%

form

solid

mp

44-46 °C (lit.)

functional group

bromo, nitro

SMILES string

[O-][N+](=O)c1ccccc1CBr

InChI

1S/C7H6BrNO2/c8-5-6-3-1-2-4-7(6)9(10)11/h1-4H,5H2

InChI key

HXBMIQJOSHZCFX-UHFFFAOYSA-N

Application

2-Nitrobenzyl bromide was used for caging unprotected cysteine-containing or thiophosphorylated peptides in aqueous solution. It can be used in the synthesis of (R)- and (S)-3-amino-3,4-dihydro-1H-quinolin-2-one.

Biochem/physiol Actions

2-Nitrobenzyl bromide reacts with L-cysteine to form S-2-nitrobenzyl-cysteine which was used for modification of ultra-low-gelling-temperature (ULGT) agarose.

pictograms

Corrosion
GHS05

signalword

Danger

hcodes

H314

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

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