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Home > Fluorides > 73086-80-3

73086-80-3

73086-80-3 | 1-Octyl-2,4,6-triphenylpyridin-1-ium tetrafluoroboranuide

CAS No: 73086-80-3 Catalog No: AG01EX7Z MDL No:MFCD00961043

Product Description

Catalog Number:
AG01EX7Z
Chemical Name:
1-Octyl-2,4,6-triphenylpyridin-1-ium tetrafluoroboranuide
CAS Number:
73086-80-3
Molecular Formula:
C31H34BF4N
Molecular Weight:
507.4130
MDL Number:
MFCD00961043
IUPAC Name:
1-octyl-2,4,6-triphenylpyridin-1-ium;tetrafluoroborate
InChI:
InChI=1S/C31H34N.BF4/c1-2-3-4-5-6-16-23-32-30(27-19-12-8-13-20-27)24-29(26-17-10-7-11-18-26)25-31(32)28-21-14-9-15-22-28;2-1(3,4)5/h7-15,17-22,24-25H,2-6,16,23H2,1H3;/q+1;-1
InChI Key:
OQHVNSZVTIPUDN-UHFFFAOYSA-N
SMILES:
F[B-](F)(F)F.CCCCCCCC[n+]1c(cc(cc1c1ccccc1)c1ccccc1)c1ccccc1

Properties

Complexity:
474  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
507.272g/mol
Formal Charge:
0
Heavy Atom Count:
37  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
507.424g/mol
Monoisotopic Mass:
507.272g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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