chempirical

Ethyl 4-hydroxyhydrocinnamate

C11H14O3CAS 23795-02-0194.23 g/mol

Open in Covalent MOL file
OOOH
EsterPhenol

Properties

Molecular formula
C11H14O3
Molar mass
194.23 g/mol
Exact mass
194.0943 Da
logP
1.89Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Identifiers

CAS number
23795-02-0
SMILES
CCOC(=O)CCC1=CC=C(C=C1)O
InChIKey
UFMFPPAZUJDUMY-UHFFFAOYSA-N
InChI
InChI=1S/C11H14O3/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-4,6-7,12H,2,5,8H2,1H3

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Work with Ethyl 4-hydroxyhydrocinnamate

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 4-hydroxyphenylacetate17138-28-274 % similar 3-(4-Bromophenyl)propionic acid ethyl ester40640-98-071 % similar Ethyl 3-phenylpropanoate2021-28-568 % similar Ethyl 3-(4-hydroxy-3-methoxyphenyl)propionate61292-90-860 % similar N-Succinimidyl 3-(4-hydroxyphenyl)propionate34071-95-956 % similar (4S)-(2,2-Dimethyl-1,3-dioxolan-4-yl)-3-(4- hydroxybenzene) propanoic acid,methyl ester (landiolol)144256-11-156 % similar [3-(2-Ethoxycarbonylethyl)phenyl]boronic acid913835-82-255 % similar Ethylparaben120-47-854 % similar

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

Same formula

Zingerone122-48-5 Ethyl p-methoxyphenylacetate14062-18-1 4-Butoxybenzoic acid1498-96-0 Methyl 3-(4-methoxyphenyl)propanoate15823-04-8 4-Isopropylphenoxyacetic acid1643-16-9 Propioveratrone1835-04-7 3,4-Diethoxybenzaldehyde2029-94-9 Butyl salicylate2052-14-4

Elsewhere

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