Catalog Number
ACM106796-3
Product Name
Dimethyl sebacate
Category
Plastic Additives; Plasticizers
Synonyms
Sebacic acid dimethyl ester, NSC 9415, Decanedioic acid 1,10-dimethyl ester, Dimethyl decanedioate
Description
Dimethyl sebacate (DMS) is a plasticizer that can be synthesized by esterification of sebacic acid.
IUPAC Name
Dimethyl decanedioate
Molecular Formula
CH3OCO(CH2)8COOCH3
Canonical SMILES
COC(=O)CCCCCCCCC(=O)OC
InChI
1S/C12H22O4/c1-15-11(13)9-7-5-3-4-6-8-10-12(14)16-2/h3-10H2,1-2H3
InChI Key
ALOUNLDAKADEEB-UHFFFAOYSA-N
Boiling Point
158 °C/10 mmHg (lit.)
Melting Point
29-31 °C (lit.)
Density
0.988 g/mL at 25 °C (lit.)
Application
DMS can be used in the synthesis of decanedihydrazide which can be used as a precursor for isocyanates for the synthesis of thermoplastic polyurethanes. Transesterification of DMS with 2-ethylhexanol can be used to synthesize bis(2-ethylhexyl)sebacate for further use in petroleum based lubricants.
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Features And Benefits
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Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
0
MeSH Entry Terms
sebacic acid dimethyl ester
Monoisotopic Mass
230.15180918
Packaging
Packaging
500 g in glass bottle
Topological Polar Surface Area
52.6 Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0