Methyl 2-acetyl-3,5-dihydroxyphenylacetate

HCID 15470976
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Basic information

Standard SMILES
COC(=O)Cc1cc(O)cc(O)c1C(C)=O
InChIKey
MDYCUZHBCOPWJQ-UHFFFAOYSA-N
Molecular formula
C11H12O5
Average molar mass
224.21 g/mol

Overview

Methyl 2-acetyl-3,5-dihydroxyphenylacetate is an aromatic ketone.

Names & identifiers

Preferred name
Methyl 2-acetyl-3,5-dihydroxyphenylacetate
IUPAC
methyl 2-(2-acetyl-3,5-dihydroxyphenyl)acetate

Names & synonyms

Methyl 2-(2-acetyl-3,5-dihydroxyphenyl)acetatemethyl 2-acetyl-3,5-dihydroxyphenylacetateRefChem:157281126495-72-5MEGxm0_000236SCHEMBL2863766CHEMBL4463814CHEBI:214725MDYCUZHBCOPWJQ-UHFFFAOYSA-NCS-0159693

Database identifiers

PubChem CID
15470976
ChEMBL
CHEMBL4463814
ChEBI
CHEBI:214725
Nikkaji
J1.430.543B

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
83.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
16

Related reactions

2 records
New reaction record

Compound notes

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Methyl 2-acetyl-3,5-dihydroxyphenylacetate (HCID 15470976)｜Huagongshe