Home Sulfos 2,4-Diphenyl-5,6,7,8-tetrahydrochromenylium trifluoromethanesulfonate

2,4-Diphenyl-5,6,7,8-tetrahydrochromenylium trifluoromethanesulfonate

CAS No.:
81128-01-0
Catalog Number:
AG008L6H
Molecular Formula:
C22H19F3O4S
Molecular Weight:
436.4441
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
tech
1 week
United States
$89
- +
1g
tech
1 week
United States
$191
- +
Product Description
Catalog Number:
AG008L6H
Chemical Name:
2,4-Diphenyl-5,6,7,8-tetrahydrochromenylium trifluoromethanesulfonate
CAS Number:
81128-01-0
Molecular Formula:
C22H19F3O4S
Molecular Weight:
436.4441
MDL Number:
MFCD00051892
IUPAC Name:
2,4-diphenyl-5,6,7,8-tetrahydrochromen-1-ium;trifluoromethanesulfonate
InChI:
InChI=1S/C21H19O.CHF3O3S/c1-3-9-16(10-4-1)19-15-21(17-11-5-2-6-12-17)22-20-14-8-7-13-18(19)20;2-1(3,4)8(5,6)7/h1-6,9-12,15H,7-8,13-14H2;(H,5,6,7)/q+1;/p-1
InChI Key:
LTJCXSMAZCZPIK-UHFFFAOYSA-M
SMILES:
c1ccc(cc1)c1[o+]c2CCCCc2c(c1)c1ccccc1.[O-]S(=O)(=O)C(F)(F)F
Properties
Complexity:
484  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
436.096g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
436.445g/mol
Monoisotopic Mass:
436.096g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties