4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol

C29H24O2 — CID 69497823

IUPAC4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol
SMILESC=CCc1cc(C2(c3ccc(O)c(C)c3)c3ccccc3-c3ccccc32)ccc1O
InChIInChI=1S/C29H24O2/c1-3-8-20-18-22(14-16-28(20)31)29(21-13-15-27(30)19(2)17-21)25-11-6-4-9-23(25)24-10-5-7-12-26(24)29/h3-7,9-18,30-31H,1,8H2,2H3
InChIKeyJIUQSBRMVFAABX-UHFFFAOYSA-N
MW404.51 g/mol
LogP6.50
Rot. Bonds4

About 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol

4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol (PubChem CID 69497823) has the molecular formula C29H24O2 and a molecular weight of 404.51 g/mol. Its IUPAC name is 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol.

Molecular Properties

Compound Name4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol
PubChem CID69497823
Molecular FormulaC29H24O2
Molecular Weight404.51 g/mol
Exact Mass404.18
IUPAC Name4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol
SMILESC=CCc1cc(C2(c3ccc(O)c(C)c3)c3ccccc3-c3ccccc32)ccc1O
InChIInChI=1S/C29H24O2/c1-3-8-20-18-22(14-16-28(20)31)29(21-13-15-27(30)19(2)17-21)25-11-6-4-9-23(25)24-10-5-7-12-26(24)29/h3-7,9-18,30-31H,1,8H2,2H3
InChIKeyJIUQSBRMVFAABX-UHFFFAOYSA-N
XLogP6.50
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.51
LogP ≤ 56.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-prop-2-enyl-4-[9-(3-prop-2-enylphenyl)fluoren-9-yl]phenol
CID 130394565
4-[9-(4-hydroxy-3-methylphenyl)fluoren-9-yl]-2,3-dimethylphenol
CID 71231529
2-butyl-4-[9-(3-butyl-4-hydroxyphenyl)fluoren-9-yl]phenol
CID 18410576
4-[9-[4-[4-[9-[4-hydroxy-3-(hydroxymethyl)phenyl]fluoren-9-yl]phenyl]phenyl]fluoren-9-yl]benzene-1,2-diol
CID 170225979
9-(4-amino-3-methylphenyl)-9-(4-hydroxy-3-methylphenyl)fluoren-2-ol
CID 144931267
4-[9-(4-hydroxy-3-prop-2-enylphenyl)-4,4a-dihydrofluoren-9-yl]-2-prop-2-enylphenol
CID 130371878
2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol
CID 23496560
4-[9-(4-hydroxy-3-methylphenyl)-4,5-dinaphthalen-2-ylfluoren-9-yl]-2-methylphenol
CID 142536435
diphenyl carbonate;4-[9-(4-hydroxy-3-methylphenyl)fluoren-9-yl]-2-methylphenol;[4-[9-[4-[[4-[9-(4-hydroxy-3-methylphenyl)fluoren-9-yl]-2-methylphenoxy]carbonyloxymethyl]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl] phenyl carbonate;[4-[9-(4-hydroxy-3-methylphenyl)fluoren-9-yl]-2-methylphenyl] [4-[9-(4-hydroxy-3-methylphenyl)fluoren-9-yl]-2-methylphenyl]methyl carbonate;[4-[9-(4-hydroxy-3-methylphenyl)fluoren-9-yl]-2-methylphenyl] phenyl carbonate;[2-methyl-4-[9-[3-methyl-4-[[2-methyl-4-[9-(3-methyl-4-phenoxycarbonyloxyphenyl)fluoren-9-yl]phenoxy]carbonyloxymethyl]phenyl]fluoren-9-yl]phenyl] phenyl carbonate;[2-methyl-4-[9-(3-methyl-4-phenoxycarbonyloxyphenyl)fluoren-9-yl]phenyl] phenyl carbonate;phenol
CID 158180786
4-[9-(4-hydroxy-3-methylphenyl)fluoren-9-yl]-2-methylphenol;methane;4-[9-(4-methylphenyl)fluoren-9-yl]phenol;2-[4-[9-(4-propoxyphenyl)fluoren-9-yl]phenoxy]ethanol
CID 159486944
9,9-bis(4-ethoxy-3-methylphenyl)fluorene
CID 143337003
[5-[9-(3-hydroxy-4-methylphenyl)fluoren-9-yl]-2-methylphenyl] formate
CID 88860019

Frequently Asked Questions

What is the IUPAC name of 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol?
The IUPAC name of 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol (CID 69497823) is 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol.
What is the SMILES notation for 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol?
The canonical SMILES for 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol is C=CCc1cc(C2(c3ccc(O)c(C)c3)c3ccccc3-c3ccccc32)ccc1O.
What is the InChIKey of 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol?
The InChIKey is JIUQSBRMVFAABX-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24O2/c1-3-8-20-18-22(14-16-28(20)31)29(21-13-15-27(30)19(2)17-21)25-11-6-4-9-23(25)24-10-5-7-12-26(24)29/h3-7,9-18,30-31H,1,8H2,2H3.
What are the key properties of 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol?
4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol has a molecular weight of 404.51 g/mol, XLogP of 6.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol is sourced from PubChem (CID 69497823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).