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Propylene glycol dilaurate

CAT: 0013-GTR19248722-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19248722-01Size:250 mg
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Description
Propylene glycol dilaurate is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
CAS Number
22788-19-8
Field of Research
Pharmacology & Drug Discovery
Smiles
CCCCCCCCCCCC (=O) OCC (C) OC (=O) CCCCCCCCCCC
Molecular Formula
C27H52O4
Molecular Weight
440.7
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Propylene Glycol Dilaurate

The CIR Expert Panel concluded that the following ingredients are safe in the present practices of use and concentration described in this safety assessment in cosmetics when formulated to be non-irritating...Propylene Glycol Dilaurate...

CAS Number22788-19-8
PubChem CID90838
IUPAC Name2-dodecanoyloxypropyl dodecanoate
Molecular FormulaC27H52O4
Molecular Weight440.7
XLogP10.8
Topological Polar Surface Area52.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count25
Heavy Atom Count31
Formal Charge0
Complexity408
SMILES
CCCCCCCCCCCC(=O)OCC(C)OC(=O)CCCCCCCCCCC
InChI
InChI=1S/C27H52O4/c1-4-6-8-10-12-14-16-18-20-22-26(28)30-24-25(3)31-27(29)23-21-19-17-15-13-11-9-7-5-2/h25H,4-24H2,1-3H3
InChIKey
WITKSCOBOCOGSC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propylene Glycol Dilaurate
CAS: 22788-19-8
CID: 90838
Formula: C27H52O4
MW: 440.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight440.7
XLogP310.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count25
Exact Mass440.38656014
Monoisotopic Mass440.38656014
Topological Polar Surface Area52.6 Ų
Heavy Atom Count31
Formal Charge0
Complexity408
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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