4-Octadecylbenzoic acid 33327-30-9 wiki

1.6 Inchi: InChI=1S/C25H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-19-21-24(22-20-23)25(26)27/h19-22H,2-18H2,1H3,(H,26,27)

4445-07-2 17 Suppliers

33327-30-9

33371-79-8

33327-30-9

3. Precursor and Product

precursor:

4445-07-2

33371-79-8

4. Computed Properties

Molecular Weight：374.6g/mol
Molecular Formula：C₂₅H₄₂O₂
Compound Is Canonicalized：True
XLogP3-AA：374.318480578
Monoisotopic Mass：374.318480578
Complexity：331
Rotatable Bond Count：18
Hydrogen Bond Donor Count：1
Hydrogen Bond Acceptor Count：2
Topological Polar Surface Area：37.3
Heavy Atom Count：：27
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADcfB4MAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGgAACAAADACAmAAyCIAAAgCIAiDSCAACAAAkAAAIiAEACMgIJjKAFRCAcQAkwAEImYeIyPCOQAAAAAAAAACAAAAAAAAAAAAAAAAAAA==

5. Realated Product Infomation