10898
Benzyl acetoacetate
Wacker Chemie AG, ≥96% (GC)
Synonym(s):
AC-benzyl, Acetoacetic acid benzyl ester
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About This Item
Linear Formula:
CH3COCH2COOCH2C6H5
CAS Number:
Molecular Weight:
192.21
Beilstein:
2049615
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Quality Level
Assay
≥96% (GC)
manufacturer/tradename
Wacker Chemie AG
refractive index
n20/D 1.512 (lit.)
bp
156-159 °C/10 mmHg (lit.)
density
1.112 g/mL at 25 °C (lit.)
SMILES string
CC(=O)CC(=O)OCc1ccccc1
InChI
1S/C11H12O3/c1-9(12)7-11(13)14-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
InChI key
WOFAGNLBCJWEOE-UHFFFAOYSA-N
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General description
Benzyl acetoacetate undergoes asymmetric bioreduction to form benzyl (S)-(+)-3-hydroxybutyrate in the presence of Candida schatavii strain MY 1831.
Other Notes
prices for bulk quantities on request
Storage Class Code
10 - Combustible liquids
WGK
WGK 1
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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