6-fluoro-1-benzothiophene

C8H5FS — CID 19088018

IUPAC6-fluoro-1-benzothiophene
SMILESFc1ccc2ccsc2c1
InChIInChI=1S/C8H5FS/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5H
InChIKeyIAWIFBMBSZRKGZ-UHFFFAOYSA-N
MW152.19 g/mol
LogP3.04
Rot. Bonds

About 6-fluoro-1-benzothiophene

6-fluoro-1-benzothiophene (PubChem CID 19088018) has the molecular formula C8H5FS and a molecular weight of 152.19 g/mol. Its IUPAC name is 6-fluoro-1-benzothiophene.

Molecular Properties

Compound Name6-fluoro-1-benzothiophene
PubChem CID19088018
Molecular FormulaC8H5FS
Molecular Weight152.19 g/mol
Exact Mass152.01
IUPAC Name6-fluoro-1-benzothiophene
SMILESFc1ccc2ccsc2c1
InChIInChI=1S/C8H5FS/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5H
InChIKeyIAWIFBMBSZRKGZ-UHFFFAOYSA-N
XLogP3.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.19
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-benzothiophene?
The IUPAC name of 6-fluoro-1-benzothiophene (CID 19088018) is 6-fluoro-1-benzothiophene.
What is the SMILES notation for 6-fluoro-1-benzothiophene?
The canonical SMILES for 6-fluoro-1-benzothiophene is Fc1ccc2ccsc2c1.
What is the InChIKey of 6-fluoro-1-benzothiophene?
The InChIKey is IAWIFBMBSZRKGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FS/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5H.
What are the key properties of 6-fluoro-1-benzothiophene?
6-fluoro-1-benzothiophene has a molecular weight of 152.19 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-benzothiophene is sourced from PubChem (CID 19088018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).