Methyl 4,4-diethoxy-3-oxobutanoate

HCID 15445487
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(OCC)C(=O)CC(=O)OC
InChIKey
SRVWVCFAHHNVNR-UHFFFAOYSA-N
Molecular formula
C9H16O5
Average molar mass
204.22 g/mol

Names & identifiers

Preferred name
Methyl 4,4-diethoxy-3-oxobutanoate
IUPAC
methyl 4,4-diethoxy-3-oxobutanoate

Names & synonyms

METHYL 4,4-DIETHOXY-3-OXOBUTANOATE83821-64-1SCHEMBL10575074SRVWVCFAHHNVNR-UHFFFAOYSA-Nmethyl gamma,gamma-diethoxyacetoacetateEN300-1127953

Database identifiers

PubChem CID
15445487

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
14

Related reactions

2 records
New reaction record

Compound notes

Loading…