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Ionizable lipid-2

CAT: 0013-GTR19232616-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19232616-02Size:10 mg
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Description
Ionizable Lipid-2 (Compound 1) is a key cationic lipid component used to formulate lipid nanoparticles (LNPs) for nucleic acid delivery. It enables efficient encapsulation and cellular release of RNA or DNA payloads in both in vitro transfection studies and in vivo therapeutic research applications.
CAS Number
2763904-72-7
Field of Research
Metabolism Research
Smiles
C (COC (OCCCCCCN (CCCCCCOC (OCC (CCCCCCCC) CCCCCC) =O) CCCCO) =O) (CCCCCCCC) CCCCCC
Molecular Formula
C50H99NO7
Molecular Weight
826.32
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ionizable lipid-2
CAS Number2763904-72-7
PubChem CID167299116
IUPAC Name6-[6-(2-hexyldecoxycarbonyloxy)hexyl-(4-hydroxybutyl)amino]hexyl 2-hexyldecyl carbonate
Molecular FormulaC50H99NO7
Molecular Weight826.3
XLogP18.7
Topological Polar Surface Area94.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count50
Heavy Atom Count58
Formal Charge0
Complexity781
SMILES
CCCCCCCCC(CCCCCC)COC(=O)OCCCCCCN(CCCCCCOC(=O)OCC(CCCCCC)CCCCCCCC)CCCCO
InChI
InChI=1S/C50H99NO7/c1-5-9-13-17-19-27-37-47(35-25-15-11-7-3)45-57-49(53)55-43-33-23-21-29-39-51(41-31-32-42-52)40-30-22-24-34-44-56-50(54)58-46-48(36-26-16-12-8-4)38-28-20-18-14-10-6-2/h47-48,52H,5-46H2,1-4H3
InChIKey
VSDPYYIVZBMTMP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ionizable lipid-2
CAS: 2763904-72-7
CID: 167299116
Formula: C50H99NO7
MW: 826.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight826.3
XLogP318.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count50
Exact Mass825.74215450
Monoisotopic Mass825.74215450
Topological Polar Surface Area94.5 Ų
Heavy Atom Count58
Formal Charge0
Complexity781
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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