Dimethyl dodecanedioate
Product Information
Molecular Formula
C14H26O4
Molecular Weight
258.36
Description
Dimethyl dodecanedioate is a multifunctional ester. Its indispensability as a pharmaceutical intermediate, facilitating varied drug and medication syntheses, bears testament to its eminence. Astoundingly, Dimethyl dodecanedioate emerges as a protagonist in yielding groundbreaking therapeutic interventions targeting the intricate intricacies of formidable afflictions such as cancer and neurological disorders.
Synonyms
Dodecanedioic Acid Dimethyl Ester
IUPAC Name
dimethyl dodecanedioate
SMILES
COC(=O)CCCCCCCCCCC(=O)OC
InChI
InChI=1S/C14H26O4/c1-17-13(15)11-9-7-5-3-4-6-8-10-12-14(16)18-2/h3-12H2,1-2H3
InChI Key
IZMOTZDBVPMOFE-UHFFFAOYSA-N
Purity
>95%
Appearance
White to Almost white powder to lump
Computed Properties
XLogP3
4.1
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
13
Exact Mass
258.18310931 g/mol
Monoisotopic Mass
258.18310931 g/mol
Topological Polar Surface Area
52.6Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
202
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
