Dimethyl Octadecanedioate

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Catalog Number
ACM1472931
Product Name
Dimethyl Octadecanedioate
Structure
Structure
CAS
1472-93-1
Category
Heterocyclic Organic Compound
Description
OtherSolid
Synonyms
octadecanedioic acid,dimethyl ester
IUPAC Name
dimethyl octadecanedioate
Molecular Weight
342.51
Molecular Formula
C20H38O4
Canonical SMILES
COC(=O)CCCCCCCCCCCCCCCCC(=O)OC
InChI
InChI=1S/C20H38O4/c1-23-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)24-2/h3-18H2,1-2H3
InChI Key
ZOXMHKCFDXHCJX-UHFFFAOYSA-N
Boiling Point
207 °C 3mmHg
Melting Point
60 °C
Storage
Room temperature
Complexity
272
Covalently-Bonded Unit Count
1
EC Number
604-582-2
Exact Mass
342.27701g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
0
Heavy Atom Count
24
Monoisotopic Mass
342.27701g/mol
Physical State
Solid
Rotatable Bond Count
19
XLogP3
7.3
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