chempirical

Isooctyl acrylate

C11H20O2CAS 29590-42-9184.28 g/mol

Open in Covalent MOL file
OO
AlkeneEster

Properties

Molecular formula
C11H20O2
Molar mass
184.28 g/mol
Exact mass
184.1463 Da
logP
2.93Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
7

Identifiers

CAS number
29590-42-9
SMILES
CC(C)CCCCCOC(=O)C=C
InChIKey
DXPPIEDUBFUSEZ-UHFFFAOYSA-N
InChI
InChI=1S/C11H20O2/c1-4-11(12)13-9-7-5-6-8-10(2)3/h4,10H,1,5-9H2,2-3H3

Weigh it out

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

Names and synonyms

8 names
  • 2-Propenoic acid, isooctyl ester
  • Acrylic acid, isooctyl ester
  • SR 440
  • Light acrylate IO-A
  • IO-AA
  • DS 2051
  • Sartomer SR 440
  • Miramer M 1084

Work with Isooctyl acrylate

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

Diisooctyl maleate1330-76-373 % similar 1,6-Hexanediol diacrylate13048-33-470 % similar 1,4-Butylene glycol diacrylate1070-70-867 % similar Hexadecyl acrylate13402-02-363 % similar Decyl acrylate2156-96-963 % similar Lauryl acrylate2156-97-063 % similar Hexyl acrylate2499-95-863 % similar Stearyl acrylate4813-57-463 % similar

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

Same formula

2-Ethylhexyl acrylate103-11-7 γ-Undecalactone104-67-6 Citronellyl formate105-85-1 2,2,6,6-Tetramethyl-3,5-heptanedione1118-71-4 Undecylenic acid112-38-9 Octyl acrylate2499-59-4 cis-3-Hexenyl isovalerate35154-45-1 cis-3-Hexenyl valerate35852-46-1

Elsewhere

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