2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol

C25H18O4 — CID 137364137

IUPAC2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol
SMILESOc1ccc(O)c(C2(c3cc(O)ccc3O)c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C25H18O4/c26-15-9-11-23(28)21(13-15)25(22-14-16(27)10-12-24(22)29)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14,26-29H
InChIKeyOHDWKGBZEXXFQV-UHFFFAOYSA-N
MW382.42 g/mol
LogP4.87
Rot. Bonds2

About 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol

2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol (PubChem CID 137364137) has the molecular formula C25H18O4 and a molecular weight of 382.42 g/mol. Its IUPAC name is 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol.

Molecular Properties

Compound Name2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol
PubChem CID137364137
Molecular FormulaC25H18O4
Molecular Weight382.42 g/mol
Exact Mass382.12
IUPAC Name2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol
SMILESOc1ccc(O)c(C2(c3cc(O)ccc3O)c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C25H18O4/c26-15-9-11-23(28)21(13-15)25(22-14-16(27)10-12-24(22)29)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14,26-29H
InChIKeyOHDWKGBZEXXFQV-UHFFFAOYSA-N
XLogP4.87
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 54.87
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

2-[9-(2-hydroxyphenyl)fluoren-9-yl]phenol
CID 14438476
5-[9-(2,4,5-trihydroxyphenyl)fluoren-9-yl]benzene-1,2,4-triol
CID 137364150
2-[9-(2,6-dihydroxyphenyl)fluoren-9-yl]benzene-1,3-diol
CID 139891134
3-[9-[3-[9-(3-hydroxyphenyl)fluoren-9-yl]phenyl]fluoren-9-yl]phenol
CID 90136304
3'-(5-chloro-2-fluorophenyl)-9,9'-spirobi[fluorene]-2'-ol
CID 145358393
9-(4-amino-3-methylphenyl)-9-(4-hydroxy-3-methylphenyl)fluoren-2-ol
CID 144931267
2-ethyl-4-[9-(3-ethyl-2,4-dihydroxyphenyl)fluoren-9-yl]benzene-1,3-diol
CID 154338119
10',10'-dioxospiro[fluorene-9,9'-thioxanthene]-2,7-diol
CID 171721504
9,9-diethylfluoren-2-ol
CID 163996675
2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol
CID 23496560
4-[9-(4-hydroxyphenyl)fluoren-9-yl]-2,3-dimethylphenol
CID 71281305
4-[7'-(4-hydroxyphenyl)spiro[fluorene-9,9'-xanthene]-2'-yl]phenol
CID 23369045

Frequently Asked Questions

What is the IUPAC name of 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol?
The IUPAC name of 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol (CID 137364137) is 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol.
What is the SMILES notation for 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol?
The canonical SMILES for 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol is Oc1ccc(O)c(C2(c3cc(O)ccc3O)c3ccccc3-c3ccccc32)c1.
What is the InChIKey of 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol?
The InChIKey is OHDWKGBZEXXFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18O4/c26-15-9-11-23(28)21(13-15)25(22-14-16(27)10-12-24(22)29)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14,26-29H.
What are the key properties of 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol?
2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol has a molecular weight of 382.42 g/mol, XLogP of 4.87, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-(2,5-dihydroxyphenyl)fluoren-9-yl]benzene-1,4-diol is sourced from PubChem (CID 137364137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).