1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol

C16H11FO2 — CID 90766733

IUPAC1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol
SMILESOc1ccc(-c2c(O)ccc3ccccc23)cc1F
InChIInChI=1S/C16H11FO2/c17-13-9-11(6-7-14(13)18)16-12-4-2-1-3-10(12)5-8-15(16)19/h1-9,18-19H
InChIKeyWVNXTZDSROJRJD-UHFFFAOYSA-N
MW254.26 g/mol
LogP4.06
Rot. Bonds1

About 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol

1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol (PubChem CID 90766733) has the molecular formula C16H11FO2 and a molecular weight of 254.26 g/mol. Its IUPAC name is 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol.

Molecular Properties

Compound Name1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol
PubChem CID90766733
Molecular FormulaC16H11FO2
Molecular Weight254.26 g/mol
Exact Mass254.07
IUPAC Name1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol
SMILESOc1ccc(-c2c(O)ccc3ccccc23)cc1F
InChIInChI=1S/C16H11FO2/c17-13-9-11(6-7-14(13)18)16-12-4-2-1-3-10(12)5-8-15(16)19/h1-9,18-19H
InChIKeyWVNXTZDSROJRJD-UHFFFAOYSA-N
XLogP4.06
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.26
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol?
The IUPAC name of 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol (CID 90766733) is 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol.
What is the SMILES notation for 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol?
The canonical SMILES for 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol is Oc1ccc(-c2c(O)ccc3ccccc23)cc1F.
What is the InChIKey of 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol?
The InChIKey is WVNXTZDSROJRJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FO2/c17-13-9-11(6-7-14(13)18)16-12-4-2-1-3-10(12)5-8-15(16)19/h1-9,18-19H.
What are the key properties of 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol?
1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol has a molecular weight of 254.26 g/mol, XLogP of 4.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol is sourced from PubChem (CID 90766733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).