4-([6-(Methacryloyloxy)hexyl]oxy)benzenecarboxylic acid

C₁₇H₂₂O₅CAS 91652-00-5306.36 g/mol

Open in Covalent MOL file

Alkene Carboxylic acid Ester Ether

Properties

Molecular formula: C₁₇H₂₂O₅
Molar mass: 306.36 g/mol
Exact mass: 306.1467 Da
logP: 3.44Crippen estimate
Polar surface area: 72.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 10

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

91652-00-5

SMILES

CC(=C)C(=O)OCCCCCCOC1=CC=C(C=C1)C(=O)O

InChIKey

KAGIRXVDTGQWKF-UHFFFAOYSA-N

InChI

InChI=1S/C17H22O5/c1-13(2)17(20)22-12-6-4-3-5-11-21-15-9-7-14(8-10-15)16(18)19/h7-10H,1,3-6,11-12H2,2H3,(H,18,19)

Weigh it out

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Work with 4-([6-(Methacryloyloxy)hexyl]oxy)benzenecarboxylic acid

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

4-(Hexyloxy)benzoic acid1142-39-862 % similar 4-(Heptyloxy)benzoic acid15872-42-162 % similar 4-(Nonyloxy)benzoic acid15872-43-262 % similar 4-Undecyloxybenzoic acid15872-44-362 % similar 4-(Dodecyloxy)benzoic acid2312-15-462 % similar Octyloxybenzoic acid2493-84-762 % similar 4-(Decyloxy)benzoic acid5519-23-362 % similar 4-((11-(Acryloyloxy)undecyl)oxy)benzoic acid106620-90-061 % similar

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

Same formula

Ethyl 2-(2-acetyl-5-((3-methylbut-2-en-1-yl)oxy)phenoxy)acetate64506-46-3

Elsewhere

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