chempirical

Divinyl adipate

C10H14O4CAS 4074-90-2198.22 g/mol

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AlkeneEster

Properties

Molecular formula
C10H14O4
Molar mass
198.22 g/mol
Exact mass
198.0892 Da
Density
1.0383 g/mL (at 20 °C)
Boiling point
133 °C (at 15 Torr)
logP
1.92Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
7

Identifiers

CAS number
4074-90-2
SMILES
C=COC(=O)CCCCC(=O)OC=C
InChIKey
JZQAAQZDDMEFGZ-UHFFFAOYSA-N
InChI
InChI=1S/C10H14O4/c1-3-13-9(11)7-5-6-8-10(12)14-4-2/h3-4H,1-2,5-8H2

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

Names and synonyms

6 names
  • Hexanedioic acid, 1,6-diethenyl ester
  • Adipic acid, divinyl ester
  • Hexanedioic acid, diethenyl ester
  • Divinyl hexanedioate
  • Diethenyl adipate
  • A 1188

Work with Divinyl adipate

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

Vinyl hexanoate3050-69-977 % similar Vinyl stearate111-63-774 % similar Vinyl decanoate4704-31-874 % similar Vinyl butyrate123-20-665 % similar Vinyl propionate105-38-458 % similar 1,6-Di-2-propen-1-yl hexanedioate2998-04-150 % similar Adipic anhydride2035-75-848 % similar Methyl 10-undecenoate111-81-944 % similar

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

Same formula

1,3-Bis(2-hydroxyethoxy)benzene102-40-9 Hydroquinone bis(2-hydroxyethyl) ether104-38-1 1,4-Butylene glycol diacrylate1070-70-8 4,5-Dihydro-2,5-dimethyl-4-oxo-3-furanyl butanoate114099-96-6 (1S,4R)-4,7,7-Trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylic acid13429-83-9 Polyethylene glycol dimethacrylate25852-47-5 3,4,5-Trimethoxybenzyl alcohol3840-31-1 2,3,4-Trimethoxybenzyl alcohol71989-96-3

Elsewhere

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