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About This Item
Empirical Formula (Hill Notation):
C7H8BrN
CAS Number:
Molecular Weight:
186.05
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
assay
97%
form
liquid
refractive index
n20/D 1.552
density
1.431 g/mL at 25 °C
SMILES string
Cc1ccc(Br)c(C)n1
InChI
1S/C7H8BrN/c1-5-3-4-7(8)6(2)9-5/h3-4H,1-2H3
InChI key
TUJVGHCSNXCAFE-UHFFFAOYSA-N
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Related Categories
signalword
Danger
hcodes
Hazard Classifications
Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk_germany
WGK 3
flash_point_f
188.1 °F
flash_point_c
86.7 °C
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Patrick W Fedick et al.
Journal of the American Society for Mass Spectrometry, 30(10), 2144-2151 (2019-08-09)
Suzuki cross-coupling is a widely performed reaction, typically using metal catalysts under heated conditions. Acceleration of the Suzuki cross-coupling reaction has been previously explored in microdroplets using desorption electrospray ionization mass spectrometry (DESI-MS). Building upon previous work, presented here is
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