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5681-36-7

5681-36-7 structural image
Product Name: 1,2-DIHEXADECANOYL-RAC-GLYCERO-3-PHOSPHOETHANOLAMINE
Formula: C37H74NO8P
Synonyms: rac-Phosphatidylethanolamine, 1,2-dipalmitoyl;DL-β,γ-Dipalmitoyl-α-cephalin;1,2-Dihexadecanoyl-rac-glycero-3-phosphoethanolamine
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 262.3 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

COMPUTED DESCRIPTORS

Molecular Weight 692.0 g/mol
XLogP3 10.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 39
Exact Mass 691.51520532 g/mol
Monoisotopic Mass 691.51520532 g/mol
Topological Polar Surface Area 134 Ų
Heavy Atom Count 47
Formal Charge 0
Complexity 754
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes