Catalog | DGS26266579 |
CAS | 26266-57-9 |
Structure | ![]() |
Synonyms | Arlacel 40 |
IUPAC Name | [2-[(2R,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] hexadecanoate |
Molecular Weight | 402.57 |
Molecular Formula | C22H42O6 |
InChI | InChI=1S/C22H42O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(25)27-17-19(24)22-21(26)18(23)16-28-22/h18-19,21-24,26H,2-17H2,1H3/t18-,19?,21+,22-/m1/s1 |
InChI Key | IYFATESGLOUGBX-CBOZIWPYSA-N |
Melting Point | 52-59 °C |
Flash Point | >230 °F |
Appearance | Tan wax |
Complexity | 389 |
EC Number | 247-568-8 |
Exact Mass | 402.29813906 |
Formal Charge | 0 |
Heavy Atom Count | 28 |
Hydrogen Bond Acceptor Count | 6 |
Hydrogen Bond Donor Count | 3 |
Isomeric SMILES | CCCCCCCCCCCCCCCC(=O)OCC([C@@H]1[C@H]([C@@H](CO1)O)O)O |
MDL Number | MFCD00080946 |
Monoisotopic Mass | 402.29813906 |
Rotatable Bond Count | 18 |
Topological Polar Surface Area | 96.2 Ų |
XLogP3-AA | 5.8 |
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