chempirical

Allyl phenoxyacetate

C11H12O3CAS 7493-74-5192.21 g/mol

Open in Covalent MOL file
OOO
AlkeneEsterEther

Properties

Molecular formula
C11H12O3
Molar mass
192.21 g/mol
Exact mass
192.0786 Da
Density
1.082 g/mL (at 20 °C)
Boiling point
137 °C (at 1 Torr)
logP
1.79Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
5

Identifiers

CAS number
7493-74-5
SMILES
C=CCOC(=O)COc1ccccc1
InChIKey
VUFZVGQUAVDKMC-UHFFFAOYSA-N
InChI
InChI=1S/C11H12O3/c1-2-8-13-11(12)9-14-10-6-4-3-5-7-10/h2-7H,1,8-9H2

Weigh it out

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

Names and synonyms

5 names
  • Acetic acid, 2-phenoxy-, 2-propen-1-yl ester
  • Acetic acid, phenoxy-, allyl ester
  • Acetic acid, phenoxy-, 2-propenyl ester
  • NSC 408892
  • Allyl 2-phenoxyacetate

Work with Allyl phenoxyacetate

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

Allyl phenylacetate1797-74-662 % similar Ethyl 2-phenoxyacetate2555-49-959 % similar Phenoxyacetic anhydride14316-61-159 % similar Allyl phenyl ether1746-13-058 % similar Methyl 2-phenoxyacetate2065-23-854 % similar Diallyl phthalate131-17-951 % similar Phenoxyacetic acid122-59-849 % similar Omnipol BP515136-48-848 % similar

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

Same formula

Dehydrozingerone1080-12-2 Helional1205-17-0 Ethyl 3-phenylglycidate121-39-1 (3-Methoxyphenyl)methyl 2-propenoate144261-46-1 δ-Oxobenzenepentanoic acid1501-05-9 1-(4-Methoxyphenyl)cyclopropanecarboxylic acid16728-01-1 5,6-Dimethoxy-1-indanone2107-69-9 4-(4-Methylphenyl)-4-oxobutanoic acid4619-20-9

Elsewhere

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