4-(4-Acryloxy-butyl-1-oxy)-benzoic acid

C₁₄H₁₆O₅CAS 69260-42-0264.28 g/mol

Open in Covalent MOL file

Alkene Carboxylic acid Ester Ether

Properties

Molecular formula: C₁₄H₁₆O₅
Molar mass: 264.28 g/mol
Exact mass: 264.0998 Da
logP: 2.27Crippen estimate
Polar surface area: 72.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 8

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

69260-42-0

SMILES

C=CC(=O)OCCCCOC1=CC=C(C=C1)C(=O)O

InChIKey

ZBWYHNHRVUSVNU-UHFFFAOYSA-N

InChI

InChI=1S/C14H16O5/c1-2-13(15)19-10-4-3-9-18-12-7-5-11(6-8-12)14(16)17/h2,5-8H,1,3-4,9-10H2,(H,16,17)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

4-(4-Acryloxybutoxy)benzoic acid

Work with 4-(4-Acryloxy-butyl-1-oxy)-benzoic 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-((11-(Acryloyloxy)undecyl)oxy)benzoic acid106620-90-097 % similar 4-[[6-[(1-Oxo-2-propen-1-yl)oxy]hexyl]oxy]benzoic acid83883-26-597 % similar 4-(3-(Acryloyloxy)propoxy)benzoic acid245349-46-695 % similar 6-(4-Hydroxyphenoxy)hexyl prop-2-enoate161841-12-968 % similar 4-[4-[(1-Oxo-2-propenyl)oxy]butoxy]benzoic acid [1,1'-biphenyl]-4-yl ester245760-39-860 % similar 4-Methoxyphenyl 4-[[6-[(1-oxo-2-propen-1-yl)oxy]hexyl]oxy]benzoate82200-53-160 % similar 4-([6-(Methacryloyloxy)hexyl]oxy)benzenecarboxylic acid91652-00-559 % similar 4-(Pentyloxy)benzoic acid15872-41-059 % similar

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

Same formula

Diethyl 2-benzoylmalonate1087-97-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook