2-fluoroquinoline-8-sulfinyl chloride

C9H5ClFNOS — CID 146582363

IUPAC2-fluoroquinoline-8-sulfinyl chloride
SMILESO=S(Cl)c1cccc2ccc(F)nc12
InChIInChI=1S/C9H5ClFNOS/c10-14(13)7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5H
InChIKeyWCJLUICSRICGHN-UHFFFAOYSA-N
MW229.66 g/mol
LogP2.64
Rot. Bonds1

About 2-fluoroquinoline-8-sulfinyl chloride

2-fluoroquinoline-8-sulfinyl chloride (PubChem CID 146582363) has the molecular formula C9H5ClFNOS and a molecular weight of 229.66 g/mol. Its IUPAC name is 2-fluoroquinoline-8-sulfinyl chloride.

Molecular Properties

Compound Name2-fluoroquinoline-8-sulfinyl chloride
PubChem CID146582363
Molecular FormulaC9H5ClFNOS
Molecular Weight229.66 g/mol
Exact Mass228.98
IUPAC Name2-fluoroquinoline-8-sulfinyl chloride
SMILESO=S(Cl)c1cccc2ccc(F)nc12
InChIInChI=1S/C9H5ClFNOS/c10-14(13)7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5H
InChIKeyWCJLUICSRICGHN-UHFFFAOYSA-N
XLogP2.64
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.66
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoroquinoline-8-sulfinyl chloride?
The IUPAC name of 2-fluoroquinoline-8-sulfinyl chloride (CID 146582363) is 2-fluoroquinoline-8-sulfinyl chloride.
What is the SMILES notation for 2-fluoroquinoline-8-sulfinyl chloride?
The canonical SMILES for 2-fluoroquinoline-8-sulfinyl chloride is O=S(Cl)c1cccc2ccc(F)nc12.
What is the InChIKey of 2-fluoroquinoline-8-sulfinyl chloride?
The InChIKey is WCJLUICSRICGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5ClFNOS/c10-14(13)7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5H.
What are the key properties of 2-fluoroquinoline-8-sulfinyl chloride?
2-fluoroquinoline-8-sulfinyl chloride has a molecular weight of 229.66 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroquinoline-8-sulfinyl chloride is sourced from PubChem (CID 146582363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).