6-fluoro-4-methyl-1-benzofuran

C9H7FO — CID 66806743

IUPAC6-fluoro-4-methyl-1-benzofuran
SMILESCc1cc(F)cc2occc12
InChIInChI=1S/C9H7FO/c1-6-4-7(10)5-9-8(6)2-3-11-9/h2-5H,1H3
InChIKeyLHNRDYCDMDRQSD-UHFFFAOYSA-N
MW150.15 g/mol
LogP2.88
Rot. Bonds

About 6-fluoro-4-methyl-1-benzofuran

6-fluoro-4-methyl-1-benzofuran (PubChem CID 66806743) has the molecular formula C9H7FO and a molecular weight of 150.15 g/mol. Its IUPAC name is 6-fluoro-4-methyl-1-benzofuran.

Molecular Properties

Compound Name6-fluoro-4-methyl-1-benzofuran
PubChem CID66806743
Molecular FormulaC9H7FO
Molecular Weight150.15 g/mol
Exact Mass150.05
IUPAC Name6-fluoro-4-methyl-1-benzofuran
SMILESCc1cc(F)cc2occc12
InChIInChI=1S/C9H7FO/c1-6-4-7(10)5-9-8(6)2-3-11-9/h2-5H,1H3
InChIKeyLHNRDYCDMDRQSD-UHFFFAOYSA-N
XLogP2.88
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.15
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-4-methyl-1-benzofuran?
The IUPAC name of 6-fluoro-4-methyl-1-benzofuran (CID 66806743) is 6-fluoro-4-methyl-1-benzofuran.
What is the SMILES notation for 6-fluoro-4-methyl-1-benzofuran?
The canonical SMILES for 6-fluoro-4-methyl-1-benzofuran is Cc1cc(F)cc2occc12.
What is the InChIKey of 6-fluoro-4-methyl-1-benzofuran?
The InChIKey is LHNRDYCDMDRQSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FO/c1-6-4-7(10)5-9-8(6)2-3-11-9/h2-5H,1H3.
What are the key properties of 6-fluoro-4-methyl-1-benzofuran?
6-fluoro-4-methyl-1-benzofuran has a molecular weight of 150.15 g/mol, XLogP of 2.88, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-4-methyl-1-benzofuran is sourced from PubChem (CID 66806743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).