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About This Item
Empirical Formula (Hill Notation):
C13H16BrNO2
CAS Number:
Molecular Weight:
298.18
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
96%
InChI
1S/C13H16BrNO2/c14-12-6-8-15(9-7-12)13(16)17-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2
SMILES string
BrC1CCN(CC1)C(=O)OCc2ccccc2
InChI key
BFWKSPOSMPKTSV-UHFFFAOYSA-N
assay
96%
refractive index
n20/D 1.5590 (lit.)
density
1.374 g/mL at 25 °C (lit.)
functional group
bromo, phenyl
Quality Level
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves
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