4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol

C15H11FO3 — CID 143318510

IUPAC4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol
SMILESCc1cc2cc(F)cc(-c3ccc(O)cc3O)c2o1
InChIInChI=1S/C15H11FO3/c1-8-4-9-5-10(16)6-13(15(9)19-8)12-3-2-11(17)7-14(12)18/h2-7,17-18H,1H3
InChIKeyOZORTRABLKUFSX-UHFFFAOYSA-N
MW258.25 g/mol
LogP3.96
Rot. Bonds1

About 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol

4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol (PubChem CID 143318510) has the molecular formula C15H11FO3 and a molecular weight of 258.25 g/mol. Its IUPAC name is 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol.

Molecular Properties

Compound Name4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol
PubChem CID143318510
Molecular FormulaC15H11FO3
Molecular Weight258.25 g/mol
Exact Mass258.07
IUPAC Name4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol
SMILESCc1cc2cc(F)cc(-c3ccc(O)cc3O)c2o1
InChIInChI=1S/C15H11FO3/c1-8-4-9-5-10(16)6-13(15(9)19-8)12-3-2-11(17)7-14(12)18/h2-7,17-18H,1H3
InChIKeyOZORTRABLKUFSX-UHFFFAOYSA-N
XLogP3.96
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.25
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-fluoro-2-[2-(methylamino)ethyl]-1-benzofuran-7-yl]-4-methylphenol
CID 143318508
2-(2-methyl-1-benzofuran-7-yl)benzene-1,3-diol
CID 143318496
4-[3-(3-fluoro-5-methylphenyl)-1,2,4-oxadiazol-5-yl]benzene-1,3-diol
CID 136904205
4-(5-fluoro-1-propan-2-ylbenzimidazol-2-yl)benzene-1,3-diol
CID 136903734
2-methyl-1-benzofuran-7-ol;piperazine
CID 174956498
4-[3-(2,4-dihydroxyphenyl)-5-methylphenyl]benzene-1,3-diol
CID 137451666
3-fluoro-4-(5-fluoro-1-benzofuran-2-yl)phenol
CID 114735944
4-(5-fluoro-1,3-benzothiazol-2-yl)-3-methylphenol
CID 136750939
4-(2,4-diethyl-5-hydroxyphenyl)benzene-1,3-diol
CID 101303234
4-ethylbenzene-1,3-diol
CID 17927
7-(3-chlorophenoxy)-5-fluoro-2-methyl-1-benzofuran
CID 165400591
4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium
CID 159824116

Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol?
The IUPAC name of 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol (CID 143318510) is 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol.
What is the SMILES notation for 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol?
The canonical SMILES for 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol is Cc1cc2cc(F)cc(-c3ccc(O)cc3O)c2o1.
What is the InChIKey of 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol?
The InChIKey is OZORTRABLKUFSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FO3/c1-8-4-9-5-10(16)6-13(15(9)19-8)12-3-2-11(17)7-14(12)18/h2-7,17-18H,1H3.
What are the key properties of 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol?
4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol has a molecular weight of 258.25 g/mol, XLogP of 3.96, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol is sourced from PubChem (CID 143318510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).