chempirical

4-Acetoxystyrene

C10H10O2CAS 2628-16-2162.19 g/mol

Open in Covalent MOL file
OO
AlkeneEster

Properties

Molecular formula
C10H10O2
Molar mass
162.19 g/mol
Exact mass
162.0681 Da
Density
1.0548 g/mL (at 25 °C)
Boiling point
80 °C (at 1.5 Torr)
logP
2.25Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
2628-16-2
SMILES
C=Cc1ccc(OC(C)=O)cc1
InChIKey
JAMNSIXSLVPNLC-UHFFFAOYSA-N
InChI
InChI=1S/C10H10O2/c1-3-9-4-6-10(7-5-9)12-8(2)11/h3-7H,1H2,2H3

Weigh it out

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

Names and synonyms

10 names
  • Phenol, 4-ethenyl-, 1-acetate
  • Phenol, p-vinyl-, acetate
  • Phenol, 4-ethenyl-, acetate
  • p-Acetoxystyrene
  • 4-Vinylphenyl acetate
  • 4-Ethenylphenol acetate
  • PACS
  • (4-Ethenylphenyl) acetate
  • 4-Acetoxy-1-ethenylbenzene
  • Acetic acid 4-vinylphenyl ester

Work with 4-Acetoxystyrene

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-(Acetyloxy)benzaldehyde878-00-266 % similar 4-Methylphenyl acetate140-39-656 % similar 3-[4-(Acetyloxy)phenyl]-2-propenoic acid15486-19-855 % similar 1,1-Dimethylethyl 4-ethenylphenyl carbonate87188-51-055 % similar Phenyl acetate122-79-255 % similar p-Aminophenyl acetate13871-68-655 % similar 4-Fluorophenyl acetate405-51-655 % similar 1-[4-(Acetyloxy)phenyl]ethanone13031-43-153 % similar

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

Same formula

γ-Phenyl-γ-butyrolactone1008-76-0 1,4-Diacetylbenzene1009-61-6 Methyl cinnamate103-26-4 Cinnamyl formate104-65-4 α-Methylcinnamic acid1199-77-5 Isosafrole120-58-1 4-Methoxy-2,3-dihydro-1H-inden-1-one13336-31-7 6-Methoxy-1-indanone13623-25-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook