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Hexadecylphosphoethanolamine

CAT: 0926-FH172166-02Size: 0.1 gDry Ice: NoHazardous: No
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CAT#:0926-FH172166-02Size:0.1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
57303-02-3
Smiles
CCCCCCCCCCCCCCCCOP (=O) ([O-]) OCCN
Molecular Formula
C18H40NO4P
Molecular Weight
365.49 g/mol
Controlled
No

Chemical Information

2-Aminoethyl hexadecyl phosphate
CAS Number57303-02-3
PubChem CID71444215
IUPAC Name2-aminoethyl hexadecyl phosphate
Molecular FormulaC18H39NO4P-
Molecular Weight364.5
XLogP5.7
Topological Polar Surface Area84.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count19
Heavy Atom Count24
Formal Charge-1
Complexity294
SMILES
CCCCCCCCCCCCCCCCOP(=O)([O-])OCCN
InChI
InChI=1S/C18H40NO4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-22-24(20,21)23-18-16-19/h2-19H2,1H3,(H,20,21)/p-1
InChIKey
BQISFTKVULMCDX-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of 2-Aminoethyl hexadecyl phosphate
CAS: 57303-02-3
CID: 71444215
Formula: C18H39NO4P-
MW: 364.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight364.5
XLogP35.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count19
Exact Mass364.26167072
Monoisotopic Mass364.26167072
Topological Polar Surface Area84.6 Ų
Heavy Atom Count24
Formal Charge-1
Complexity294
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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