2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol

C16H11FO2 — CID 155195828

IUPAC2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol
SMILESOc1cccc(O)c1-c1cc2ccccc2cc1F
InChIInChI=1S/C16H11FO2/c17-13-9-11-5-2-1-4-10(11)8-12(13)16-14(18)6-3-7-15(16)19/h1-9,18-19H
InChIKeyLINKFIVRXBSEOK-UHFFFAOYSA-N
MW254.26 g/mol
LogP4.06
Rot. Bonds1

About 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol

2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol (PubChem CID 155195828) has the molecular formula C16H11FO2 and a molecular weight of 254.26 g/mol. Its IUPAC name is 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol.

Molecular Properties

Compound Name2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol
PubChem CID155195828
Molecular FormulaC16H11FO2
Molecular Weight254.26 g/mol
Exact Mass254.07
IUPAC Name2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol
SMILESOc1cccc(O)c1-c1cc2ccccc2cc1F
InChIInChI=1S/C16H11FO2/c17-13-9-11-5-2-1-4-10(11)8-12(13)16-14(18)6-3-7-15(16)19/h1-9,18-19H
InChIKeyLINKFIVRXBSEOK-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 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol?
The IUPAC name of 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol (CID 155195828) is 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol.
What is the SMILES notation for 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol?
The canonical SMILES for 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol is Oc1cccc(O)c1-c1cc2ccccc2cc1F.
What is the InChIKey of 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol?
The InChIKey is LINKFIVRXBSEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FO2/c17-13-9-11-5-2-1-4-10(11)8-12(13)16-14(18)6-3-7-15(16)19/h1-9,18-19H.
What are the key properties of 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol?
2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol 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 2-(3-fluoronaphthalen-2-yl)benzene-1,3-diol is sourced from PubChem (CID 155195828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).