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About This Item
Empirical Formula (Hill Notation):
C11H12O3S
CAS Number:
Molecular Weight:
224.28
UNSPSC Code:
12352200
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
2650656
InChI
1S/C11H12O3S/c1-4-10(3)14-15(12,13)11-7-5-9(2)6-8-11/h1,5-8,10H,2-3H3
SMILES string
CC(OS(=O)(=O)c1ccc(C)cc1)C#C
InChI key
XWRDBUBKBUYLQI-UHFFFAOYSA-N
assay
≥95.0% (HPLC), 95%
form
powder
storage temp.
2-8°C
Storage Class
13 - Non Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
Regulatory Information
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On the Stereochemistry of the Aromatic Claisen Rearrangement. Thermal Rearrangement of erythroid and threoid ortho-Dienones.
Wunderli, A. et al.,
Helvetica Chimica Acta, 60, 2436-2459 (1977)
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