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6-bromo-9,9'-diphenyl-3,3'-bicarbazole

6-bromo-9,9'-diphenyl-3,3'-bicarbazole

CAS: 918137-84-5

Formula: C36H23BrN2

SMILES: BrC1=CC2=C(C=C1)N(C1=C2C=C(C=C1)C1=CC2=C(C=C1)N(C1=C2C=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: 6-bromo-9,9'-diphenyl-9H,9'H-3,3'-bicarbazole

InChI: InChI=1S/C36H23BrN2/c37-26-17-20-36-32(23-26)31-22-25(16-19-35(31)39(36)28-11-5-2-6-12-28)24-15-18-34-30(21-24)29-13-7-8-14-33(29)38(34)27-9-3-1-4-10-27/h1-23H

Composition: C (76.73%), H (4.11%), Br (14.18%), N (4.97%)

Molar Mass: 563.498

Atom Count: 62

Heavy Atom Count: 39

Properties
Properties
Common Names N/A
Aromatic Ring Count 8
Asymmetric Atom Count 0
Exact Mass 562.104462
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey LCJYRCMTHQJILZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 183.63
Topological Polar Surface Area 9.86
Polarizability 70.3
Ring Count 8
Rotatable Bond Count 3

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