10899
Methyl 3-oxoheptanoate
≥96.0% (GC)
Synonym(s):
VEM, Methyl valerylacetate
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About This Item
Linear Formula:
CH3(CH2)3COCH2COOCH3
CAS Number:
Molecular Weight:
158.19
PubChem Substance ID:
UNSPSC Code:
12352100
Beilstein/REAXYS Number:
1761380
MDL number:
assay
≥96.0% (GC)
manufacturer/tradename
Wacker Chemie AG
bp
90-91 °C/15 hPa (lit.)
density
0.994 g/mL at 20 °C (lit.)
SMILES string
CCCCC(=O)CC(=O)OC
InChI
1S/C8H14O3/c1-3-4-5-7(9)6-8(10)11-2/h3-6H2,1-2H3
InChI key
CZTKGERSDUGZPQ-UHFFFAOYSA-N
General description
Methyl 3-oxoheptanoate undergoes Pechmann condensation with 2-methyl resorcinol using H2SO4 condensing agent to form 7-hydroxy-8-methyl coumarins.
Application
Methyl 3-oxoheptanoate was used in the synthesis of 3(R,S)-hydroxyheptanoic acid.
Other Notes
prices for bulk quantities on request
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
203.0 °F
flash_point_c
95 °C
ppe
Eyeshields, Gloves
Regulatory Information
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