Ethyl 2-(2-formyl-4-methoxyphenoxy)acetate

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Basic information

CAS: 76322-07-1
Standard SMILES: CCOC(=O)COc1ccc(OC)cc1C=O
InChIKey: RHMNGOYVUSIANQ-UHFFFAOYSA-N
Molecular formula: C12H14O5
Average molar mass: 238.24 g/mol
Monoisotopic mass: 238.08412355

Names & identifiers

Preferred name: Ethyl 2-(2-formyl-4-methoxyphenoxy)acetate
IUPAC: ethyl 2-(2-formyl-4-methoxyphenoxy)acetate

Names & synonyms

76322-07-1(2-Formyl-4-methoxy-phenoxy)-acetic acid ethyl esterethyl 2-(2-formyl-4-methoxyphenoxy)acetateNSC149947SCHEMBL3643556DTXSID00997688RHMNGOYVUSIANQ-UHFFFAOYSA-NAKOS005863412NSC-149947Ethyl (2-formyl-4-methoxyphenoxy)acetate

Database identifiers

CAS: 76322-07-1
PubChem CID: 288667
DTXSID: DTXSID00997688

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

3 records

New reaction record

HRID 493166As productuspto-grants-2009_05

HRID 493167As reactantuspto-grants-2009_05

HRID 2145060As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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