CAS
94023-25-3 Purity
96%
94023-25-3 Purity
96%
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Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester
CAS
94023-28-6
Catalog Number
ACM94023286
Category
Other Products
Molecular Weight
877.10556
Molecular Formula
C42H84O18
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Specification
Density
1.168g/cm³
What is the molecular formula of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The molecular formula is C42H84O18.
What is the molecular weight of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The molecular weight is 877.1 g/mol.
What is the IUPAC name of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The IUPAC name is [3-[3-[3-[3-[3-[3-[3-(2,3-dihydroxypropoxy)-2-hydroxypropoxy]-2-hydroxypropoxy]-2-hydroxypropoxy]-2-hydroxypropoxy]-2-hydroxypropoxy]-2-hydroxypropoxy]-2-hydroxypropyl] octadecanoate.
What is the InChI of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The InChI is InChI=1S/C42H84O18/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-42(52)60-33-41(51)32-59-31-40(50)30-58-29-39(49)28-57-27-38(48)26-56-25-37(47)24-55-23-36(46)22-54-21-35(45)20-53-19-34(44)18-43/h34-41,43-51H,2-33H2,1H3
What is the InChIKey of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The InChIKey is VANIXXKHZVDVAK-UHFFFAOYSA-N.
What is the Canonical SMILES of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The Canonical SMILES is CCCCCCCCCCCCCCCCCC(=O)OCC(COCC(COCC(COCC(COCC(COCC(COCC(COCC(CO)O)O)O)O)O)O)O)O.
What is the XLogP3 value of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The XLogP3 value is 2.1.
How many Hydrogen Bond Donor Count does Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester have?
It has 9 Hydrogen Bond Donor Count.
What is the Rotatable Bond Count of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The Rotatable Bond Count is 48.
What is the Topological Polar Surface Area of Octadecanoic acid,2,6,10,14,18,22,26,30,31-nonahydroxy-4,8,12,16,20,24,28-heptaoxahentriacont-1-ylester?
The Topological Polar Surface Area is 273 Ų.
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