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Dioctyl Decanedioate

CAT: 0931-T21166-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T21166-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2432-87-3
Target
Others
Related Pathways
Others
Bioactivity
Dioctyl Decanedioate is commonly used as a plasticiser and is widely used in biochemical experiments and drug synthesis research.
Smiles
O=C(OCCCCCCCC)CCCCCCCCC(=O)OCCCCCCCC
Molecular Formula
C26H50O4
Molecular Weight
426.67
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Dioctyl decanedioate
CAS Number2432-87-3
PubChem CID75516
IUPAC Namedioctyl decanedioate
Molecular FormulaC26H50O4
Molecular Weight426.7
XLogP9.6
Topological Polar Surface Area52.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count25
Heavy Atom Count30
Formal Charge0
Complexity345
SMILES
CCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCC
InChI
InChI=1S/C26H50O4/c1-3-5-7-9-15-19-23-29-25(27)21-17-13-11-12-14-18-22-26(28)30-24-20-16-10-8-6-4-2/h3-24H2,1-2H3
InChIKey
MIMDHDXOBDPUQW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dioctyl decanedioate
CAS: 2432-87-3
CID: 75516
Formula: C26H50O4
MW: 426.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight426.7
XLogP39.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count25
Exact Mass426.37091007
Monoisotopic Mass426.37091007
Topological Polar Surface Area52.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity345
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T21158-01Diethyl decanedioate
T201704-01Dioleyl phosphatidylserine

Alternative Products

CatalogName
AR-D06590-01Dioctyl Decanedioate
OR1078552-01Diisopropyl Decanedioate
HY-W013466-01Dimethyl decanedioate
HY-W009443-01Diethyl decanedioate
OR1061664-01Dihexyl decanedioate
HY-W415282Di-tert-butyl decanedioate
HY-W009443R-01Diethyl decanedioate (Standard)
447290-01Dioctyl Phenylphosphonate
163878Dioctyl Terepthalate
RG-A260493-01Dioctyl Sebacate

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