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Myristyl laurate

CAT: 0013-GTR19245252-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19245252-01Size:100 mg
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Description
Myristyl laurate 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
22412-97-1
Smiles
CCCCCCCCCCCC (OCCCCCCCCCCCCCC) =O
Molecular Formula
C26H52O2
Molecular Weight
396.69
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Myristyl Laurate

The CIR Expert Panel concluded that the alkyl esters, listed subsequently, are safe in the present practices of use and concentration described in this safety assessment when formulated to be non-irritating.

CAS Number22412-97-1
PubChem CID89700
IUPAC Nametetradecyl dodecanoate
Molecular FormulaC26H52O2
Molecular Weight396.7
XLogP11.9
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count24
Heavy Atom Count28
Formal Charge0
Complexity301
SMILES
CCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC
InChI
InChI=1S/C26H52O2/c1-3-5-7-9-11-13-14-15-17-19-21-23-25-28-26(27)24-22-20-18-16-12-10-8-6-4-2/h3-25H2,1-2H3
InChIKey
FNMPODAQERUMDD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Myristyl Laurate
CAS: 22412-97-1
CID: 89700
Formula: C26H52O2
MW: 396.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight396.7
XLogP311.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count24
Exact Mass396.396730897
Monoisotopic Mass396.396730897
Topological Polar Surface Area26.3 Ų
Heavy Atom Count28
Formal Charge0
Complexity301
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

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