6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol

C16H10F2O2 — CID 56648223

IUPAC6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol
SMILESOc1cc(F)c(-c2ccc3c(O)cccc3c2)cc1F
InChIInChI=1S/C16H10F2O2/c17-13-8-16(20)14(18)7-12(13)10-4-5-11-9(6-10)2-1-3-15(11)19/h1-8,19-20H
InChIKeyIGPHVZNBHOCRCA-UHFFFAOYSA-N
MW272.25 g/mol
LogP4.20
Rot. Bonds1

About 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol

6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol (PubChem CID 56648223) has the molecular formula C16H10F2O2 and a molecular weight of 272.25 g/mol. Its IUPAC name is 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol.

Molecular Properties

Compound Name6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol
PubChem CID56648223
Molecular FormulaC16H10F2O2
Molecular Weight272.25 g/mol
Exact Mass272.06
IUPAC Name6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol
SMILESOc1cc(F)c(-c2ccc3c(O)cccc3c2)cc1F
InChIInChI=1S/C16H10F2O2/c17-13-8-16(20)14(18)7-12(13)10-4-5-11-9(6-10)2-1-3-15(11)19/h1-8,19-20H
InChIKeyIGPHVZNBHOCRCA-UHFFFAOYSA-N
XLogP4.20
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.25
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol?
The IUPAC name of 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol (CID 56648223) is 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol.
What is the SMILES notation for 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol?
The canonical SMILES for 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol is Oc1cc(F)c(-c2ccc3c(O)cccc3c2)cc1F.
What is the InChIKey of 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol?
The InChIKey is IGPHVZNBHOCRCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F2O2/c17-13-8-16(20)14(18)7-12(13)10-4-5-11-9(6-10)2-1-3-15(11)19/h1-8,19-20H.
What are the key properties of 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol?
6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol has a molecular weight of 272.25 g/mol, XLogP of 4.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-difluoro-4-hydroxyphenyl)naphthalen-1-ol is sourced from PubChem (CID 56648223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).