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4,6-dibromo-1H-indole

4,6-dibromo-1H-indole

CAS: 99910-50-6

Formula: C8H5Br2N

SMILES: BrC1=CC(Br)=C2C=CNC2=C1

IUPAC: 4,6-dibromo-1H-indole

InChI: InChI=1S/C8H5Br2N/c9-5-3-7(10)6-1-2-11-8(6)4-5/h1-4,11H

Composition: C (34.95%), H (1.83%), Br (58.12%), N (5.09%)

Molar Mass: 274.943

Atom Count: 16

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 272.878875
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 1
InChIKey PXUDJVIHHHIEGO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.39
Topological Polar Surface Area 15.79
Polarizability 21.16
Ring Count 2
Rotatable Bond Count 0

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