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53217-64-4 | 2,4-Diphenyl-5H,6H-1-4-benzo[h]chromen-1-ylium tetrafluoroborate
CAS No: 53217-64-4 Catalog No: AG01EWD7 MDL No:
Product Description
Catalog Number:
AG01EWD7
Chemical Name:
2,4-Diphenyl-5H,6H-1-4-benzo[h]chromen-1-ylium tetrafluoroborate
CAS Number:
53217-64-4
Molecular Formula:
C25H19BF4O
Molecular Weight:
422.2224
IUPAC Name:
2,4-diphenyl-5,6-dihydrobenzo[h]chromen-1-ium;tetrafluoroborate
InChI:
InChI=1S/C25H19O.BF4/c1-3-9-18(10-4-1)23-17-24(20-12-5-2-6-13-20)26-25-21-14-8-7-11-19(21)15-16-22(23)25;2-1(3,4)5/h1-14,17H,15-16H2;/q+1;-1
InChI Key:
HMCURVDYNNCAIR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cc(c2ccccc2)c2c([o+]1)c1ccccc1CC2.F[B-](F)(F)F
Properties
Complexity:
466
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.147g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
422.23g/mol
Monoisotopic Mass:
422.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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