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5,7-dibromo-1,2-benzoxazol-3-amine

5,7-dibromo-1,2-benzoxazol-3-amine

CAS: 89583-81-3

Formula: C7H4Br2N2O

SMILES: NC1=NOC2=C(Br)C=C(Br)C=C12

IUPAC: 5,7-dibromo-1,2-benzoxazol-3-amine

InChI: InChI=1S/C7H4Br2N2O/c8-3-1-4-6(5(9)2-3)12-11-7(4)10/h1-2H,(H2,10,11)

Composition: C (28.80%), H (1.38%), Br (54.74%), N (9.60%), O (5.48%)

Molar Mass: 291.93

Atom Count: 16

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 289.869039
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HPUXUECNTFPIJF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.09
Topological Polar Surface Area 52.05
Polarizability 20.86
Ring Count 2
Rotatable Bond Count 0

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