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8-bromoisoquinolin-6-ol

8-bromoisoquinolin-6-ol

CAS: 1220694-88-1

Formula: C9H6BrNO

SMILES: OC1=CC2=CC=NC=C2C(Br)=C1

IUPAC: 8-bromoisoquinolin-6-ol

InChI: InChI=1S/C9H6BrNO/c10-9-4-7(12)3-6-1-2-11-5-8(6)9/h1-5,12H

Composition: C (48.25%), H (2.70%), Br (35.66%), N (6.25%), O (7.14%)

Molar Mass: 224.057

Atom Count: 18

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 222.963277
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey SVMOLLGJWZXMCX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.95
Topological Polar Surface Area 33.12
Polarizability 20.25
Ring Count 2
Rotatable Bond Count 0

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