Isobutyl stearate

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Catalog Number
ACM646139
Product Name
Isobutyl stearate
Structure
Structure
CAS
646-13-9
Category
Heterocyclic Organic Compound
Synonyms
Octadecanoic acid isobutyl ester
IUPAC Name
2-Methylpropyl octadecanoate
Molecular Weight
340.6
Molecular Formula
C22H44O2
Canonical SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(C)C
InChI
InChI=1S/C22H44O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(23)24-20-21(2)3/h21H,4-20H2,1-3H3
InChI Key
ORFWYUFLWUWSFM-UHFFFAOYSA-N
Boiling Point
381.5 °C
Melting Point
20 °C
Density
0.85 g/cm³ at 20 °C(lit.)
Solubility
Very soluble in ether
Exact Mass
340.334130642
Monoisotopic Mass
340.334130642
Physical State
Liquid
Refractive Index
n20/D 1.4365(lit.)
Storage Conditions
Below +30 °C
Topological Polar Surface Area
26.3 Ų
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