chempirical

Butyl oleate

C22H42O2CAS 142-77-8338.58 g/mol

Open in Covalent MOL file
OO
AlkeneEster

Properties

Molecular formula
C22H42O2
Molar mass
338.58 g/mol
Exact mass
338.3185 Da
Density
0.8704 g/mL (at 15 °C)
Melting point
−26.4 °C
Boiling point
228 °C (at 15 Torr)
Flash point
180 °C
logP
7.37Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
18

Hazards

Warning
Irritant (GHS07)

Aggregated from 376 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
142-77-8
SMILES
CCCCCCCC/C=CCCCCCCCC(=O)OCCCC
InChIKey
WIBFFTLQMKKBLZ-SEYXRHQNSA-N
InChI
InChI=1S/C22H42O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(23)24-21-6-4-2/h12-13H,3-11,14-21H2,1-2H3/b13-12-

Weigh it out

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

Names and synonyms

16 names · show all
  • 9-Octadecenoic acid (9Z)-, butyl ester
  • Oleic acid, butyl ester
  • 9-Octadecenoic acid (Z)-, butyl ester
  • Hallco C 503
  • Kessco 554
  • Kesscoflex BO
  • Wilmar butyl oleate
  • Witcizer 100
  • Witcizer 101
  • Advaplast 42
  • n-Butyl oleate
  • Butyl cis-9-octadecenoate
  • Plasthall 914
  • Kemester 4000
  • Butyl (Z)-9-octadecenoate
  • Kaolube 804

Work with Butyl oleate

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

Decyl oleate3687-46-593 % similar Butyl laurate106-18-383 % similar Butyl myristate110-36-183 % similar Butyl palmitate111-06-883 % similar Butyl stearate123-95-583 % similar Butyl decanoate30673-36-083 % similar Butyl octanoate589-75-383 % similar Dibutyl sebacate109-43-379 % similar

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

Same formula

Erucic acid112-86-7 Stearyl methacrylate32360-05-7 Brassidic acid506-33-2

Elsewhere

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