Ethyl 7-methoxy-1-benzofuran-2-carboxylate

C₁₂H₁₂O₄CAS 50551-58-1220.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₂O₄
Molar mass: 220.22 g/mol
Exact mass: 220.0736 Da
logP: 2.62Crippen estimate
Polar surface area: 48.7 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

50551-58-1

SMILES

CCOC(=O)C1=CC2=C(O1)C(=CC=C2)OC

InChIKey

SXCMZYVXJUJIDJ-UHFFFAOYSA-N

InChI

InChI=1S/C12H12O4/c1-3-15-12(13)10-7-8-5-4-6-9(14-2)11(8)16-10/h4-7H,3H2,1-2H3

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Names and synonyms

1 names

Ethyl 7-methoxybenzofuran-2-carboxylate

Work with Ethyl 7-methoxy-1-benzofuran-2-carboxylate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-(7-Methoxy-2-benzofuranyl)ethanone43071-52-962 % similar 7-Methoxy-1-benzofuran-2-carboxylic acid4790-79-861 % similar 2-Benzofurancarboxylic acid ethyl ester3199-61-960 % similar Ethyl 2-methoxybenzoate7335-26-457 % similar 7-Ethoxybenzofuran-2-carboxylic acid206559-61-754 % similar Ethyl 2-methoxy-6-methylbenzoate6520-83-852 % similar Diethyl 2,5-furandicarboxylate53662-83-250 % similar Ethyl 5-aminobenzofuran-2-carboxylate174775-48-549 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

6,7-Dimethoxy-4-methyl-2H-1-benzopyran-2-one4281-40-7

Elsewhere

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