Products 5461-06-3

CAS 5461-06-3 appears in our catalog under these names: Isobutyl n-octanoate, 98%, Isobutyl caprylate, 99%, Isobutyl n–Octanoate, Isobutyl n-Octanoate, >99.0%(GC), Isobutyl caprylate. Offered by: Combi-blocks, AmBeed, GLPBio, TCI, MedChemExpress. Available pack sizes: 1g, 5g, 25g, 100g, 100ml, 25ml, 500ml, 25 mL.

Isobutyl n-octanoate, 98%
Combi-blocks
  • size: 1g, 5g, 25g, 100g
  • Variants: 4
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Isobutyl caprylate, 99%
AmBeed
  • size: 1g, 5g
  • Variants: 2
from 154.63
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Isobutyl n–Octanoate
GLPBio
  • size: 100ml, 25ml
  • Variants: 2
from 517.47
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Isobutyl n-Octanoate, >99.0%(GC)
TCI
  • size: 25ml, 500ml
  • Variants: 2
from 147.85
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Isobutyl caprylate
MedChemExpress
  • size: 25 mL
  • Variants: 1
from 384.71
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Structural formula: {0} (CAS {1})

Isobutyl octanoate is a fatty acid ester.

Source: ChEBI

Identity
Molecular formulaC12H24O2
Molecular weight200.32 g/mol
IUPAC name2-methylpropyl octanoate
InChIKeyCFQRBRGFNFRMBD-UHFFFAOYSA-N
SMILESCCCCCCCC(=O)OCC(C)C

Computed by PubChem (NCBI)

Synonyms: Isobutyl octanoate, 2-methylpropyl octanoate, Isobutyl caprylate, n-Caprylic acid isobutyl ester, Octanoic acid, isobutyl ester, iso-Butyl caprylate, Octanoic acid, 2-methylpropyl ester, iso-Butyl n-octanoate, Isobutyl caprylate (natural), Isobutyl caprylic acid
Isomers (same molecular formula)
2-methylpropyl 2-ethylhexanoate C12H24O2
2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol C12H24O2
2-heptyl-4-methyl-1,3-dioxane C12H24O2
2-ethylhexyl butanoate C12H24O2
3-ethyldecanoic acid C12H24O2
methyl undecanoate C12H24O2
butyl 2-ethylhexanoate C12H24O2
octyl butanoate C12H24O2
hexyl hexanoate C12H24O2
decyl acetate C12H24O2
cyclododecane-1,2-diol C12H24O2
2-nonyl-1,3-dioxolane C12H24O2