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Tert-butyl malonate (HCID 21883978)|Huagongshe
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Compound
Tert-butyl malonate
HCID
21883978
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CC(C)(C)OC(=O)CC(=O)[O-]
InChIKey
NGGGZUAEOKRHMA-UHFFFAOYSA-M
Molecular formula
C7H11O4-
Average molar mass
159.16 g/mol
Names & identifiers
Preferred name
Tert-butyl malonate
IUPAC
3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoate
Names & synonyms
mono-tert butyl malonate
TERT-BUTYL MALONATE
NGGGZUAEOKRHMA-UHFFFAOYSA-M
Database identifiers
PubChem CID
21883978
Properties
Computed structural properties
XLogP
1.4
Topological polar surface area
66.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
11
Formal charge
-1
Complexity
160
Show all 8
Show all 8 / 8
Related reactions
42 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
6916
As reactant
uspto-grants-2006_08
HRID
41757
As reactant
uspto-grants-2013_09
HRID
41758
As reactant
uspto-grants-2013_09
HRID
41759
As reactant
uspto-grants-2013_09
HRID
41760
As reactant
uspto-grants-2013_09
HRID
41761
As reactant
uspto-grants-2013_09
HRID
41762
As reactant
uspto-grants-2013_09
HRID
41763
As reactant
uspto-grants-2013_09
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