5-chloro-2-naphthalen-2-yloxyphenol

C16H11ClO2 — CID 71718966

IUPAC5-chloro-2-naphthalen-2-yloxyphenol
SMILESOc1cc(Cl)ccc1Oc1ccc2ccccc2c1
InChIInChI=1S/C16H11ClO2/c17-13-6-8-16(15(18)10-13)19-14-7-5-11-3-1-2-4-12(11)9-14/h1-10,18H
InChIKeyPDNCXSWHFTWSBA-UHFFFAOYSA-N
MW270.72 g/mol
LogP4.99
Rot. Bonds2

About 5-chloro-2-naphthalen-2-yloxyphenol

5-chloro-2-naphthalen-2-yloxyphenol (PubChem CID 71718966) has the molecular formula C16H11ClO2 and a molecular weight of 270.72 g/mol. Its IUPAC name is 5-chloro-2-naphthalen-2-yloxyphenol.

Molecular Properties

Compound Name5-chloro-2-naphthalen-2-yloxyphenol
PubChem CID71718966
Molecular FormulaC16H11ClO2
Molecular Weight270.72 g/mol
Exact Mass270.04
IUPAC Name5-chloro-2-naphthalen-2-yloxyphenol
SMILESOc1cc(Cl)ccc1Oc1ccc2ccccc2c1
InChIInChI=1S/C16H11ClO2/c17-13-6-8-16(15(18)10-13)19-14-7-5-11-3-1-2-4-12(11)9-14/h1-10,18H
InChIKeyPDNCXSWHFTWSBA-UHFFFAOYSA-N
XLogP4.99
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-naphthalen-2-yloxyphenol?
The IUPAC name of 5-chloro-2-naphthalen-2-yloxyphenol (CID 71718966) is 5-chloro-2-naphthalen-2-yloxyphenol.
What is the SMILES notation for 5-chloro-2-naphthalen-2-yloxyphenol?
The canonical SMILES for 5-chloro-2-naphthalen-2-yloxyphenol is Oc1cc(Cl)ccc1Oc1ccc2ccccc2c1.
What is the InChIKey of 5-chloro-2-naphthalen-2-yloxyphenol?
The InChIKey is PDNCXSWHFTWSBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClO2/c17-13-6-8-16(15(18)10-13)19-14-7-5-11-3-1-2-4-12(11)9-14/h1-10,18H.
What are the key properties of 5-chloro-2-naphthalen-2-yloxyphenol?
5-chloro-2-naphthalen-2-yloxyphenol has a molecular weight of 270.72 g/mol, XLogP of 4.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-naphthalen-2-yloxyphenol is sourced from PubChem (CID 71718966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).