Ethyl 2-(2-formyl-5-methoxyphenoxy)acetate

HCID 21476959

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CCOC(=O)COc1cc(OC)ccc1C=O
InChIKey: KNSFGKWYJGYZQH-UHFFFAOYSA-N
Molecular formula: C12H14O5
Average molar mass: 238.24 g/mol

Names & identifiers

Preferred name: Ethyl 2-(2-formyl-5-methoxyphenoxy)acetate
IUPAC: ethyl 2-(2-formyl-5-methoxyphenoxy)acetate

Names & synonyms

Ethyl 2-(2-formyl-5-methoxyphenoxy)acetateSCHEMBL177349KNSFGKWYJGYZQH-UHFFFAOYSA-N

Database identifiers

PubChem CID: 21476959

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 61.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 17
Formal charge: 0
Complexity: 253

Related reactions

7 records

New reaction record

HRID 710330 reaction equation

HRID 710330As productuspto-grants-2015_11

HRID 710331 reaction equation

HRID 710331As reactantuspto-grants-2015_11

HRID 717704 reaction equation

HRID 717704As productuspto-grants-2015_11

HRID 717705 reaction equation

HRID 717705As reactantuspto-grants-2015_11

HRID 1153553 reaction equation

HRID 1153553As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 2046109 reaction equation

HRID 2046109As productuspto-grants-2013_11

HRID 2046110 reaction equation

HRID 2046110As reactantuspto-grants-2013_11

Compound notes

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