Structure Database (LMSD)
Common Name
Behenoyl-EA
Systematic Name
N-(Docosanoyl)-ethanolamine
Synonyms
- Behenoyl-ethanolamine
3D model of Behenoyl-EA
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
References
String Representations
InChiKey (Click to copy)
XHFWUECSNJWBJU-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C24H49NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(27)25-22-23-26/h26H,2-23H2,1H3,(H,25,27)
SMILES (Click to copy)
C(CCCCCCCCCCCCC(=O)NCCO)CCCCCCCC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
27
Rings
0
Aromatic Rings
0
Rotatable Bonds
22
Van der Waals Molecular Volume
449.70
Topological Polar Surface Area
49.33
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
7.49
Molar Refractivity
119.09
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Created at
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Updated at
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