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2410-28-8 | 9-Octadecenoic acid (9Z)-, 1,1'-[1-[[(1-oxooctadecyl)oxy]methyl]-1,2-ethanediyl] ester
CAS No: 2410-28-8 Catalog No: AG0009TV MDL No:
Product Description
Catalog Number:
AG0009TV
Chemical Name:
9-Octadecenoic acid (9Z)-, 1,1'-[1-[[(1-oxooctadecyl)oxy]methyl]-1,2-ethanediyl] ester
CAS Number:
2410-28-8
IUPAC Name:
2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl octadecanoate
InChI:
InChI=1S/C57H106O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25,27-28,30,54H,4-24,26,29,31-53H2,1-3H3/b28-25-,30-27-
InChI Key:
RYNHWWNZNIGDAQ-CDAVXRBQSA-N
Properties
Complexity:
1020
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
886.799g/mol
Formal Charge:
0
Heavy Atom Count:
63
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
887.469g/mol
Monoisotopic Mass:
886.799g/mol
Rotatable Bond Count:
54
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
23.3
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