zinc 5-chloro-7-(18F)fluoroquinolin-8-ol

C9H5ClFNOZn+2 — CID 10378005

IUPACzinc 5-chloro-7-(18F)fluoroquinolin-8-ol
SMILESOc1c([18F])cc(Cl)c2cccnc12.[Zn+2]
InChIInChI=1S/C9H5ClFNO.Zn/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;/h1-4,13H;/q;+2/i11-1;
InChIKeyVOIBHURTCXFQLV-ICTZXKMBSA-N
MW261.99 g/mol
LogP2.73
Rot. Bonds

About zinc 5-chloro-7-(18F)fluoroquinolin-8-ol

zinc 5-chloro-7-(18F)fluoroquinolin-8-ol (PubChem CID 10378005) has the molecular formula C9H5ClFNOZn+2 and a molecular weight of 261.99 g/mol. Its IUPAC name is zinc 5-chloro-7-(18F)fluoroquinolin-8-ol.

Molecular Properties

Compound Namezinc 5-chloro-7-(18F)fluoroquinolin-8-ol
PubChem CID10378005
Molecular FormulaC9H5ClFNOZn+2
Molecular Weight261.99 g/mol
Exact Mass259.93
IUPAC Namezinc 5-chloro-7-(18F)fluoroquinolin-8-ol
SMILESOc1c([18F])cc(Cl)c2cccnc12.[Zn+2]
InChIInChI=1S/C9H5ClFNO.Zn/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;/h1-4,13H;/q;+2/i11-1;
InChIKeyVOIBHURTCXFQLV-ICTZXKMBSA-N
XLogP2.73
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.99
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

5,7-dichloroquinolin-8-ol;nickel
CID 175096460
7-fluoro-5-methylquinolin-8-ol
CID 59613713
bis(5-chloro-7-iodoquinolin-8-ol);gallium-67(3+)
CID 25009413
bis(5-chloro-7-iodoquinolin-8-ol);indium-111(3+)
CID 25009411
5-chloro-7-(chloromethyl)quinolin-8-ol
CID 4702114
5-chloro-6-fluoroquinolin-8-ol
CID 166150236
5-chloro-8-hydroxyquinoline-7-carboxylic acid
CID 14534767
(5-chloro-8-hydroxyquinolin-7-yl)-trimethylazanium
CID 87200187
5-chloro-7-[[(2-fluorophenyl)methylamino]methyl]quinolin-8-ol;hydrochloride
CID 138620659
bis(5-chloro-7-iodoquinolin-8-ol);propane;zirconium
CID 174375866
5-chloro-7-pentan-3-ylquinolin-8-ol
CID 91402893
2-(7-fluoro-8-hydroxyquinolin-5-yl)acetaldehyde
CID 88572009

Frequently Asked Questions

What is the IUPAC name of zinc 5-chloro-7-(18F)fluoroquinolin-8-ol?
The IUPAC name of zinc 5-chloro-7-(18F)fluoroquinolin-8-ol (CID 10378005) is zinc 5-chloro-7-(18F)fluoroquinolin-8-ol.
What is the SMILES notation for zinc 5-chloro-7-(18F)fluoroquinolin-8-ol?
The canonical SMILES for zinc 5-chloro-7-(18F)fluoroquinolin-8-ol is Oc1c([18F])cc(Cl)c2cccnc12.[Zn+2].
What is the InChIKey of zinc 5-chloro-7-(18F)fluoroquinolin-8-ol?
The InChIKey is VOIBHURTCXFQLV-ICTZXKMBSA-N. The full InChI is InChI=1S/C9H5ClFNO.Zn/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;/h1-4,13H;/q;+2/i11-1;.
What are the key properties of zinc 5-chloro-7-(18F)fluoroquinolin-8-ol?
zinc 5-chloro-7-(18F)fluoroquinolin-8-ol has a molecular weight of 261.99 g/mol, XLogP of 2.73, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for zinc 5-chloro-7-(18F)fluoroquinolin-8-ol is sourced from PubChem (CID 10378005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).