2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol

C37H30O4 — CID 22221785

IUPAC2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol
SMILESOc1ccccc1.Oc1ccccc1.Oc1ccccc1-c1ccc2c(c1-c1ccccc1O)Cc1ccccc1-2
InChIInChI=1S/C25H18O2.2C6H6O/c26-23-11-5-3-9-19(23)20-14-13-18-17-8-2-1-7-16(17)15-22(18)25(20)21-10-4-6-12-24(21)27;2*7-6-4-2-1-3-5-6/h1-14,26-27H,15H2;2*1-5,7H
InChIKeyKKRWLAXGEZRCIW-UHFFFAOYSA-N
MW538.64 g/mol
LogP8.79
Rot. Bonds2

About 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol

2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol (PubChem CID 22221785) has the molecular formula C37H30O4 and a molecular weight of 538.64 g/mol. Its IUPAC name is 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol.

Molecular Properties

Compound Name2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol
PubChem CID22221785
Molecular FormulaC37H30O4
Molecular Weight538.64 g/mol
Exact Mass538.21
IUPAC Name2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol
SMILESOc1ccccc1.Oc1ccccc1.Oc1ccccc1-c1ccc2c(c1-c1ccccc1O)Cc1ccccc1-2
InChIInChI=1S/C25H18O2.2C6H6O/c26-23-11-5-3-9-19(23)20-14-13-18-17-8-2-1-7-16(17)15-22(18)25(20)21-10-4-6-12-24(21)27;2*7-6-4-2-1-3-5-6/h1-14,26-27H,15H2;2*1-5,7H
InChIKeyKKRWLAXGEZRCIW-UHFFFAOYSA-N
XLogP8.79
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500538.64
LogP ≤ 58.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

3-[1-(2,3-dihydroxyphenyl)-9H-fluoren-2-yl]benzene-1,2-diol
CID 141152647
3-[1-(3-hydroxy-2-methylphenyl)-9H-fluoren-2-yl]-2-methylphenol
CID 160868332
1,1'-biphenyl;4-[1-(4-hydroxyphenyl)-9H-fluoren-2-yl]phenol
CID 174876060
1,2-bis(2-ethynylphenyl)-9H-fluorene
CID 139911372
1,2-bis(2-methylphenyl)-9H-fluorene
CID 23369064
1,1'-biphenyl;9H-fluorene;phenol
CID 161306435
2-(9H-fluoren-1-yl)-4-phenylbenzene-1,3-diol
CID 151135384
4-(9H-fluoren-1-yl)benzene-1,2,3-triol
CID 139434157
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
2-amino-3-[4-[1-[4-(2-amino-3-hydroxyphenyl)phenyl]-9H-fluoren-2-yl]phenyl]phenol
CID 141049173
2-fluoro-1-phenyl-9H-fluorene
CID 151671400
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol?
The IUPAC name of 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol (CID 22221785) is 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol.
What is the SMILES notation for 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol?
The canonical SMILES for 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol is Oc1ccccc1.Oc1ccccc1.Oc1ccccc1-c1ccc2c(c1-c1ccccc1O)Cc1ccccc1-2.
What is the InChIKey of 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol?
The InChIKey is KKRWLAXGEZRCIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18O2.2C6H6O/c26-23-11-5-3-9-19(23)20-14-13-18-17-8-2-1-7-16(17)15-22(18)25(20)21-10-4-6-12-24(21)27;2*7-6-4-2-1-3-5-6/h1-14,26-27H,15H2;2*1-5,7H.
What are the key properties of 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol?
2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol has a molecular weight of 538.64 g/mol, XLogP of 8.79, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol is sourced from PubChem (CID 22221785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).