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About This Item
Empirical Formula (Hill Notation):
C5H7NO
CAS Number:
Molecular Weight:
97.12
EC Number:
206-100-2
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
3935337
MDL number:
InChI key
FICAQKBMCKEFDI-UHFFFAOYSA-N
InChI
1S/C5H7NO/c1-4-3-5(2)7-6-4/h3H,1-2H3
SMILES string
Cc1cc(C)on1
assay
≥98.0% (GC)
manufacturer/tradename
Wacker Chemie AG
refractive index
n20/D 1.442 (lit.)
bp
142-144 °C (lit.)
density
0.99 g/mL at 25 °C (lit.)
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