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3-bromo-1H-pyrrolo[2,3-b]pyridin-5-amine

3-bromo-1H-pyrrolo[2,3-b]pyridin-5-amine

CAS: 1190321-04-0

Formula: C7H6BrN3

SMILES: NC1=CN=C2NC=C(Br)C2=C1

IUPAC: 3-bromo-1H-pyrrolo[2,3-b]pyridin-5-amine

InChI: InChI=1S/C7H6BrN3/c8-6-3-11-7-5(6)1-4(9)2-10-7/h1-3H,9H2,(H,10,11)

Composition: C (39.65%), H (2.85%), Br (37.68%), N (19.82%)

Molar Mass: 212.05

Atom Count: 17

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 210.97451
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey GPHYNRYMNQHOLV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.26
Topological Polar Surface Area 54.7
Polarizability 17.92
Ring Count 2
Rotatable Bond Count 0

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