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About This Item
Linear Formula:
(CH3)3CO2CCH2CH2CO2CH3
CAS Number:
Molecular Weight:
188.22
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
97%
refractive index
n20/D 1.421 (lit.)
bp
85-95 °C/20 mmHg (lit.)
density
1.022 g/mL at 25 °C (lit.)
SMILES string
COC(=O)CCC(=O)OC(C)(C)C
InChI
1S/C9H16O4/c1-9(2,3)13-8(11)6-5-7(10)12-4/h5-6H2,1-4H3
InChI key
KGLNZUDBQPORRI-UHFFFAOYSA-N
Related Categories
General description
tert-Butyl methyl succinate is an ester. Mixture of its threo- and erythro- isomeric forms were obtained by the addition reaction between tert-butyl alcohol and 4-oxo-but-3-enoate in the presence of lithium tert-butoxide (catalyst).
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
230.0 °F - closed cup
Flash Point(C)
110 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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Danheiser RL.
Science of Synthesis: Houben-Weyl Methods of Molecular Transformations, 689-689 (2014)
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