Ethyl 4-oxo-4,5,6,7-tetrahydrobenzofuran-3-carboxylic acid

HCID 21953055
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Basic information

Standard SMILES
CCc1oc2c(c1C(=O)O)C(=O)CCC2
InChIKey
LGVUFXDDJVXLBW-UHFFFAOYSA-N
Molecular formula
C11H12O4
Average molar mass
208.21 g/mol

Names & identifiers

Preferred name
Ethyl 4-oxo-4,5,6,7-tetrahydrobenzofuran-3-carboxylic acid
IUPAC
2-ethyl-4-oxo-6,7-dihydro-5H-1-benzofuran-3-carboxylic acid

Names & synonyms

SCHEMBL4899874LGVUFXDDJVXLBW-UHFFFAOYSA-Nethyl 4-oxo-4,5,6,7-tetrahydrobenzofuran-3-carboxylic acid

Database identifiers

PubChem CID
21953055

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
67.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
15

Related reactions

8 records
New reaction record

Linked notes

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