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DLPE

CAT: 1118-LP-R4-064-05Size: 10 gDry Ice: NoHazardous: No
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CAT#:1118-LP-R4-064-05Size:10 g
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CAS Number
42436-56-6
Purity
≥99% (HPTLC)
Molecular Weight
579.75
Related Products
DMPE, DOPE, DPPE, 1,3-DPPE, DPyPE, DSPE, 1,2-POPE
Grade
R&D

Chemical Information

3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(dodecanoyloxy)propyl dodecanoate

1,2-didodecanoyl-sn-glycero-3-phosphoethanolamine is an organic molecular entity.

CAS Number42436-56-6
PubChem CID108390
IUPAC Name[3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-dodecanoyloxypropyl] dodecanoate
Molecular FormulaC29H58NO8P
Molecular Weight579.7
XLogP5.9
Topological Polar Surface Area134
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count31
Heavy Atom Count39
Formal Charge0
Complexity634
SMILES
CCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCC
InChI
InChI=1S/C29H58NO8P/c1-3-5-7-9-11-13-15-17-19-21-28(31)35-25-27(26-37-39(33,34)36-24-23-30)38-29(32)22-20-18-16-14-12-10-8-6-4-2/h27H,3-26,30H2,1-2H3,(H,33,34)
InChIKey
ZLGYVWRJIZPQMM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(dodecanoyloxy)propyl dodecanoate
CAS: 42436-56-6
CID: 108390
Formula: C29H58NO8P
MW: 579.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight579.7
XLogP35.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count31
Exact Mass579.39000481
Monoisotopic Mass579.39000481
Topological Polar Surface Area134 Ų
Heavy Atom Count39
Formal Charge0
Complexity634
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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