Ethyl 2-(1-hydroxy-1-methyl-2-oxopropyl)-2-methylundecanoate

HCID 20164024
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Basic information

Standard SMILES
CCCCCCCCCC(C)(C(=O)OCC)C(C)(O)C(C)=O
InChIKey
MDRYWBADWALJCN-UHFFFAOYSA-N
Molecular formula
C18H34O4
Average molar mass
314.5 g/mol
Monoisotopic mass
314.24570956

Names & identifiers

Preferred name
Ethyl 2-(1-hydroxy-1-methyl-2-oxopropyl)-2-methylundecanoate
IUPAC
ethyl 2-(2-hydroxy-3-oxobutan-2-yl)-2-methylundecanoate

Names & synonyms

SCHEMBL10802579MDRYWBADWALJCN-UHFFFAOYSA-NEthyl 2-(1-hydroxy-1-methyl-2-oxopropyl)-2-methylundecanoate

Database identifiers

PubChem CID
20164024

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
63.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
13
Heavy atoms
22

Related reactions

3 records
New reaction record

Linked notes

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