1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol

C26H18O3 — CID 143531986

IUPAC1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol
SMILESOc1cccc(-c2c(O)ccc3ccc(Oc4ccc5ccccc5c4)cc23)c1
InChIInChI=1S/C26H18O3/c27-21-7-3-6-20(14-21)26-24-16-23(12-9-18(24)10-13-25(26)28)29-22-11-8-17-4-1-2-5-19(17)15-22/h1-16,27-28H
InChIKeyAYCMQKRJAXNPRT-UHFFFAOYSA-N
MW378.43 g/mol
LogP6.86
Rot. Bonds3

About 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol

1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol (PubChem CID 143531986) has the molecular formula C26H18O3 and a molecular weight of 378.43 g/mol. Its IUPAC name is 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol.

Molecular Properties

Compound Name1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol
PubChem CID143531986
Molecular FormulaC26H18O3
Molecular Weight378.43 g/mol
Exact Mass378.13
IUPAC Name1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol
SMILESOc1cccc(-c2c(O)ccc3ccc(Oc4ccc5ccccc5c4)cc23)c1
InChIInChI=1S/C26H18O3/c27-21-7-3-6-20(14-21)26-24-16-23(12-9-18(24)10-13-25(26)28)29-22-11-8-17-4-1-2-5-19(17)15-22/h1-16,27-28H
InChIKeyAYCMQKRJAXNPRT-UHFFFAOYSA-N
XLogP6.86
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.43
LogP ≤ 56.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenylnaphthalene-2,7-diol
CID 118054370
3-anthracen-9-ylphenol
CID 91210590
bis(9,9-dimethylfluorene);ethane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;2-naphthalen-2-yloxynaphthalene
CID 159643599
7-[2-hydroxy-7-[(7-hydroxy-7,8-dihydronaphthalen-2-yl)oxy]naphthalen-1-yl]-1-(7-hydroxynaphthalen-2-yl)naphthalen-2-ol
CID 144615548
2-(3,5-dinaphthalen-2-yloxyphenoxy)naphthalene
CID 135017313
1-[4,6-bis(4-phenoxyphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol;2-chloro-4,6-bis(4-phenoxyphenyl)-1,3,5-triazine;naphthalen-2-ol
CID 157063536
1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol
CID 11415880
3-[2-hydroxy-6-(3-hydroxyphenyl)naphthalen-1-yl]benzoic acid
CID 25069442
6-(10-naphthalen-2-ylanthracen-9-yl)naphthalen-2-ol
CID 58876156
1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol
CID 90766733
bis(naphthalene-2,7-diol);naphthalen-1-ol
CID 174973186
5-[2-hydroxy-5-(5-hydroxynaphthalen-2-yl)oxynaphthalen-1-yl]-1-(6-hydroxynaphthalen-1-yl)naphthalen-2-ol;5-[2-hydroxy-5-(6-hydroxynaphthalen-1-yl)oxynaphthalen-1-yl]-1-(6-hydroxynaphthalen-1-yl)naphthalen-2-ol;1-(6-hydroxynaphthalen-1-yl)-5-(5-hydroxynaphthalen-2-yl)oxynaphthalen-2-ol;1-(6-hydroxynaphthalen-1-yl)-5-(6-hydroxynaphthalen-1-yl)oxynaphthalen-2-ol;1-(6-hydroxynaphthalen-1-yl)-5-[5-(6-hydroxynaphthalen-1-yl)oxynaphthalen-2-yl]oxynaphthalen-2-ol;1-(6-hydroxynaphthalen-1-yl)-5-[6-(6-hydroxynaphthalen-1-yl)oxynaphthalen-1-yl]oxynaphthalen-2-ol;5-(6-hydroxynaphthalen-1-yl)oxynaphthalen-2-ol;bis(5-[5-(6-hydroxynaphthalen-1-yl)oxynaphthalen-2-yl]oxynaphthalen-2-ol)
CID 158125548

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol?
The IUPAC name of 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol (CID 143531986) is 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol.
What is the SMILES notation for 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol?
The canonical SMILES for 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol is Oc1cccc(-c2c(O)ccc3ccc(Oc4ccc5ccccc5c4)cc23)c1.
What is the InChIKey of 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol?
The InChIKey is AYCMQKRJAXNPRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18O3/c27-21-7-3-6-20(14-21)26-24-16-23(12-9-18(24)10-13-25(26)28)29-22-11-8-17-4-1-2-5-19(17)15-22/h1-16,27-28H.
What are the key properties of 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol?
1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol has a molecular weight of 378.43 g/mol, XLogP of 6.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxyphenyl)-7-naphthalen-2-yloxynaphthalen-2-ol is sourced from PubChem (CID 143531986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).