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143873-85-2

143873-85-2 | Pyridine, 5-[(2-fluorooctyl)oxy]-2-(4-octylphenyl)-

CAS No: 143873-85-2 Catalog No: AG001IIV MDL No:

Product Description

Catalog Number:
AG001IIV
Chemical Name:
Pyridine, 5-[(2-fluorooctyl)oxy]-2-(4-octylphenyl)-
CAS Number:
143873-85-2
Molecular Formula:
C27H40FNO
Molecular Weight:
413.6110
IUPAC Name:
5-(2-fluorooctoxy)-2-(4-octylphenyl)pyridine
InChI:
InChI=1S/C27H40FNO/c1-3-5-7-9-10-11-13-23-15-17-24(18-16-23)27-20-19-26(21-29-27)30-22-25(28)14-12-8-6-4-2/h15-21,25H,3-14,22H2,1-2H3
InChI Key:
BOODGXHEUXTDSF-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1ccc(cc1)c1ccc(cn1)OCC(CCCCCC)F

Properties

Complexity:
396  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
413.309g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
413.621g/mol
Monoisotopic Mass:
413.309g/mol
Rotatable Bond Count:
16  
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
9.8  

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