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About This Item
Empirical Formula (Hill Notation):
C8H11BrN2O
CAS Number:
Molecular Weight:
231.09
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
assay
96%
density
1.493 g/mL at 25 °C
SMILES string
Brc1cnn(c1)C2CCCCO2
InChI
1S/C8H11BrN2O/c9-7-5-10-11(6-7)8-3-1-2-4-12-8/h5-6,8H,1-4H2
InChI key
HDNCEUNJWJHWMO-UHFFFAOYSA-N
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
>230.0 °F - closed cup
flash_point_c
> 110 °C - closed cup
Regulatory Information
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