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10,10'-dimethyl-[9,9'-biacridine]-10,10'-diium; bis(nitric acid)

10,10'-dimethyl-[9,9'-biacridine]-10,10'-diium; bis(nitric acid)

CAS: 2315-97-1

Formula: C28H24N4O6

SMILES: O[N+]([O-])=O.O[N+]([O-])=O.C[N+]1=C2C=CC=CC2=C(C2=CC=CC=C12)C1=C2C=CC=CC2=[N+](C)C2=CC=CC=C12

IUPAC: 10,10'-dimethyl-[9,9'-biacridine]-10,10'-diium; bis(nitric acid)

InChI: InChI=1S/C28H22N2.2HNO3/c1-29-23-15-7-3-11-19(23)27(20-12-4-8-16-24(20)29)28-21-13-5-9-17-25(21)30(2)26-18-10-6-14-22(26)28;2*2-1(3)4/h3-18H,1-2H3;2*(H,2,3,4)/q+2;;

Composition: C (65.62%), H (4.72%), N (10.93%), O (18.73%)

Molar Mass: 512.521

Atom Count: 62

Heavy Atom Count: 38

Properties
Properties
Common Names N/A
Aromatic Ring Count 6
Asymmetric Atom Count 0
Exact Mass 512.168487349
Formal Charge 2
FSP3 0.07
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey HBVBBXUCVVNMIV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 124.5
Topological Polar Surface Area 7.76
Polarizability 54.3
Ring Count 6
Rotatable Bond Count 0

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