1,1-Dimethylethyl 4-ethenylphenyl carbonate

C₁₃H₁₆O₃CAS 87188-51-0220.27 g/mol

Open in Covalent MOL file

Alkene Carbonate

Properties

Molecular formula: C₁₃H₁₆O₃
Molar mass: 220.27 g/mol
Exact mass: 220.1099 Da
logP: 3.64Crippen estimate
Polar surface area: 35.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

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

87188-51-0

SMILES

C=Cc1ccc(OC(=O)OC(C)(C)C)cc1

InChIKey

GJWMYLFHBXEWNZ-UHFFFAOYSA-N

InChI

InChI=1S/C13H16O3/c1-5-10-6-8-11(9-7-10)15-12(14)16-13(2,3)4/h5-9H,1H2,2-4H3

Weigh it out

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Names and synonyms

6 names

Carbonic acid, 1,1-dimethylethyl 4-ethenylphenyl ester
p-(tert-Butoxycarbonyloxy)styrene
4-(tert-Butoxycarbonyloxy)styrene
4-BOC-styrene
tert-Butyl p-vinylphenyl carbonate
4-t-Butyloxycarbonyloxystyrene

Work with 1,1-Dimethylethyl 4-ethenylphenyl carbonate

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

tert-Butyl phenyl carbonate6627-89-061 % similar (4-((tert-Butoxycarbonyl)oxy)phenyl)boronicacid380430-70-656 % similar 1-(1,1-Dimethylethoxy)-4-ethenylbenzene95418-58-956 % similar 4-Ethenylphenyl acetate2628-16-255 % similar 4-Vinylanisole637-69-443 % similar Di-tert-butyl dicarbonate24424-99-540 % similar 1-Ethenyl-4-ethoxybenzene5459-40-540 % similar 1-(1,1-Dimethylethoxy)-3-ethenylbenzene105612-79-140 % similar

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

Same formula

Alpha-Cyclopentylmandelic acid427-49-6 Ethyl alpha-benzylacetoacetate620-79-1 cis-3-Hexenyl salicylate65405-77-8 3-Cyclopentyloxy-4-methoxybenzaldehyde67387-76-2 ζ-Oxobenzeneheptanoic acid7472-43-7

Elsewhere

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