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4,6-dibromo-1H-1,3-benzodiazole

4,6-dibromo-1H-1,3-benzodiazole

CAS: 69038-75-1

Formula: C7H4Br2N2

SMILES: BrC1=CC(Br)=C2N=CNC2=C1

IUPAC: 4,6-dibromo-1H-1,3-benzodiazole

InChI: InChI=1S/C7H4Br2N2/c8-4-1-5(9)7-6(2-4)10-3-11-7/h1-3H,(H,10,11)

Composition: C (30.47%), H (1.46%), Br (57.92%), N (10.15%)

Molar Mass: 275.931

Atom Count: 15

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 273.874124
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey WFXKGQHCCZDOLT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.21
Topological Polar Surface Area 28.68
Polarizability 20.39
Ring Count 2
Rotatable Bond Count 0

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