Ethyl 2-(4'-hydroxyphenyl)-1,3-oxazole-4-carboxylate

C₁₂H₁₁NO₄CAS 200400-76-6233.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₁NO₄
Molar mass: 233.22 g/mol
Exact mass: 233.0688 Da
logP: 2.22Crippen estimate
Polar surface area: 72.6 Å²
H-bond donors / acceptors: 1 / 5
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

200400-76-6

SMILES

CCOC(=O)C1=COC(=N1)C2=CC=C(C=C2)O

InChIKey

XILWQVZWGWQRNU-UHFFFAOYSA-N

InChI

InChI=1S/C12H11NO4/c1-2-16-12(15)10-7-17-11(13-10)8-3-5-9(14)6-4-8/h3-7,14H,2H2,1H3

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Names and synonyms

1 names

Ethyl 2-(4-hydroxyphenyl)oxazole-4-carboxylate

Work with Ethyl 2-(4'-hydroxyphenyl)-1,3-oxazole-4-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

Ethyl 2-amino-1,3-oxazole-4-carboxylate177760-52-054 % similar Ethyl 2-chlorooxazole-4-carboxylate460081-18-954 % similar Ethyl 2-bromo-1,3-oxazole-4-carboxylate460081-20-354 % similar Ethylparaben120-47-853 % similar Ethyl 2-(4-hydroxyphenyl)-4-methyl-5-thiazolecarboxylate161797-99-551 % similar Diethyl 2,6-pyridinedicarboxylate15658-60-348 % similar 6-Aminopyridine-2-carboxylic acid ethyl ester69142-64-945 % similar Ethyl oxazole-4-carboxylate23012-14-845 % similar

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

Same formula

7-Amino-4-methylcoumarin-3-acetic acid106562-32-7 Methyl 1,4-dihydro-7-methoxy-4-oxo-6-quinolinecarboxylate205448-65-3 4-Phthalimidobutyric acid3130-75-4 Ethyl 4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylate40059-53-8 Dimethyl indole-2,3-dicarboxylate54781-93-0

Elsewhere

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