ChemicalBook--->CAS DataBase List--->2089251-33-0

2089251-33-0

2089251-33-0 Structure

2089251-33-0 Structure
IdentificationBack Directory
[Name]

Heptadecan-9-yl 8-((2-hydroxyethyl)(8-nonyloxy)-8-oxooctyl)amino)octanoate
[CAS]

2089251-33-0
[Synonyms]

Lipid 5
nonyl 8-[2-hydroxyethyl-[8-(1-octylnonoxy)-8-oxo-octyl]amino]octanoate
Heptadecan-9-yl 8-((2-hydroxyethyl)(8-nonyloxy)-8-oxooctyl)amino)octanoate
[Molecular Formula]

C44H87NO5
[MDL Number]

MFCD33402176
[MOL File]

2089251-33-0.mol
[Molecular Weight]

710.17
Chemical PropertiesBack Directory
[Boiling point ]

725.8±50.0 °C(Predicted)
[density ]

0.925±0.06 g/cm3(Predicted)
[solubility ]

Soluble in Ethanol, DMSO, DMF
[form ]

Liquid
[pka]

14.67±0.10(Predicted)
[color ]

Colorless to light yellow
[InChIKey]

ABCVHPIKBGRCJA-UHFFFAOYSA-N
[SMILES]

C(OC(CCCCCCCC)CCCCCCCC)(=O)CCCCCCCN(CCO)CCCCCCCC(OCCCCCCCCC)=O
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictogramsGHS hazard pictograms
GHS02,GHS08
[Signal word ]

Danger
[Hazard statements ]

H225-H350
[Precautionary statements ]

P201-P202-P210-P233-P240-P241-P242-P243-P280-P303+P361+P353-P308+P313-P370+P378-P403+P235-P405-P501
Hazard InformationBack Directory
[Description]

7-[(2-Hydroxyethyl)[8-(nonyloxy)-8-oxooctyl]amino]heptyl 2-octyldecanoate, analog of ALC-0315, is a ionizable, physiological pH cationic synthetic lipid that is used with other lipids to form lipid nanoparticles(LNP) for drug delivery.
[Uses]

Lipid 5 is an amino lipid that affords efficient mRNA delivery in rodent and primate models. Lipid 5 shows optimal pharmacokinetics and non-toxic side effects[1].
[in vivo]

Clearance of Lipid 5 and MC3 from multiple mouse tissues is measured after dosing 0.05 mg/kg mRNA on days 1, 8, and 15 in CD-1 female mice. Liver and spleen have the highest levels of Lipid 5, however, significantly lower levels than MC3. Lipid 5 is detected in plasma, lung, and kidney, but not in heart[1].

[References]

[1] Staci Sabnis, et al. A Novel Amino Lipid Series for mRNA Delivery: Improved Endosomal Escape and Sustained Pharmacology and Safety in Non-human Primates. Mol Ther. 2018 Jun 6;26(6):1509-1519. DOI:10.1016/j.ymthe.2018.03.010
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