chempirical

1-Ethenyl-4-ethoxybenzene

C10H12OCAS 5459-40-5148.21 g/mol

Open in Covalent MOL file
O
AlkeneEther

Properties

Molecular formula
C10H12O
Molar mass
148.21 g/mol
Exact mass
148.0888 Da
Density
0.994 g/mL (at 20 °C)
Boiling point
99–100 °C (at 11 Torr)
logP
2.73Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Identifiers

CAS number
5459-40-5
SMILES
C=Cc1ccc(OCC)cc1
InChIKey
OBRYRJYZWVLVLF-UHFFFAOYSA-N
InChI
InChI=1S/C10H12O/c1-3-9-5-7-10(8-6-9)11-4-2/h3,5-8H,1,4H2,2H3

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Names and synonyms

7 names
  • Benzene, 1-ethenyl-4-ethoxy-
  • Phenetole, p-vinyl-
  • 4-Ethoxystyrene
  • p-Vinylphenetol
  • p-Ethoxystyrene
  • NSC 24179
  • 1-Ethoxy-4-vinylbenzene

Work with 1-Ethenyl-4-ethoxybenzene

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

1,4-Diethoxybenzene122-95-263 % similar 4-Ethoxybenzaldehyde10031-82-060 % similar 1-Ethenyl-4-(1-ethoxyethoxy)benzene157057-20-057 % similar 4-Vinylanisole637-69-455 % similar Ethyl phenyl ether103-73-150 % similar P-Phenetidine156-43-450 % similar 1-Ethoxy-4-fluorobenzene459-26-750 % similar 4-Bromophenetole588-96-550 % similar

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

Same formula

1-Phenyl-2-butanone1007-32-5 Anethole104-46-1 5,6,7,8-Tetrahydro-2-naphthol1125-78-6 Cuminaldehyde122-03-2 Estragole140-67-0 Allyl benzyl ether14593-43-2 1-(2,5-Dimethylphenyl)ethanone2142-73-6 Benzylacetone2550-26-7

Elsewhere

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