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isoquinolin-2-ium-2-olate

isoquinolin-2-ium-2-olate

CAS: 1532-72-5

Formula: C9H7NO

SMILES: [O-][N+]1=CC2=CC=CC=C2C=C1

IUPAC: isoquinolin-2-ium-2-olate

InChI: InChI=1S/C9H7NO/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H

Composition: C (74.47%), H (4.86%), N (9.65%), O (11.02%)

Molar Mass: 145.161

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 145.052763849
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey RZIAABRFQASVSW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.66
Topological Polar Surface Area 26.94
Polarizability 17.44
Ring Count 2
Rotatable Bond Count 0

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