chempirical

Diallyl phthalate

C14H14O4CAS 131-17-9246.26 g/mol

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AlkeneEster

Properties

Molecular formula
C14H14O4
Molar mass
246.26 g/mol
Exact mass
246.0892 Da
Density
1.12 g/mL (at 20 °C)
Melting point
−70 °C
Boiling point
158–165 °C (at 4 Torr)
logP
2.37Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6

Identifiers

CAS number
131-17-9
SMILES
C=CCOC(=O)c1ccccc1C(=O)OCC=C
InChIKey
QUDWYFHPNIMBFC-UHFFFAOYSA-N
InChI
InChI=1S/C14H14O4/c1-3-9-17-13(15)11-7-5-6-8-12(11)14(16)18-10-4-2/h3-8H,1-2,9-10H2

Weigh it out

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

Names and synonyms

16 names · show all
  • 1,2-Benzenedicarboxylic acid, 1,2-di-2-propen-1-yl ester
  • Phthalic acid, diallyl ester
  • 1,2-Benzenedicarboxylic acid, di-2-propenyl ester
  • Dapon R
  • Allyl phthalate
  • Dappu
  • DAP-M
  • DT 170
  • DAP Monomer
  • Dap tohto DT 170
  • NSC 7667
  • Daiso DAP monomer
  • KY 5200
  • DAP
  • Monoplex DAP
  • DCP-A

Work with Diallyl phthalate

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

Triallyl trimellitate2694-54-467 % similar Allyl phenylacetate1797-74-659 % similar Diethyl phthalate84-66-255 % similar Benzyl phthalate523-31-953 % similar Dipropyl phthalate131-16-852 % similar Allyl cinnamate1866-31-551 % similar Allyl phenoxyacetate7493-74-551 % similar Bis(2-methoxyethyl) phthalate117-82-850 % similar

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

Same formula

Diallyl terephthalate1026-92-2 Diallyl isophthalate1087-21-4 Marmesin13849-08-6 (+)-Decursinol23458-02-8 (+)-Columbianetin3804-70-4 Nodakenetin495-32-9

Elsewhere

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