2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol

C33H26O2 — CID 67660456

IUPAC2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol
SMILESOCCOc1c(-c2ccccc2)cc(-c2cccc3c2Cc2ccccc2-3)cc1-c1ccccc1
InChIInChI=1S/C33H26O2/c34-18-19-35-33-30(23-10-3-1-4-11-23)21-26(22-31(33)24-12-5-2-6-13-24)28-16-9-17-29-27-15-8-7-14-25(27)20-32(28)29/h1-17,21-22,34H,18-20H2
InChIKeyUIMMVOFPUTWUPA-UHFFFAOYSA-N
MW454.57 g/mol
LogP7.63
Rot. Bonds6

About 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol

2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol (PubChem CID 67660456) has the molecular formula C33H26O2 and a molecular weight of 454.57 g/mol. Its IUPAC name is 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol.

Molecular Properties

Compound Name2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol
PubChem CID67660456
Molecular FormulaC33H26O2
Molecular Weight454.57 g/mol
Exact Mass454.19
IUPAC Name2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol
SMILESOCCOc1c(-c2ccccc2)cc(-c2cccc3c2Cc2ccccc2-3)cc1-c1ccccc1
InChIInChI=1S/C33H26O2/c34-18-19-35-33-30(23-10-3-1-4-11-23)21-26(22-31(33)24-12-5-2-6-13-24)28-16-9-17-29-27-15-8-7-14-25(27)20-32(28)29/h1-17,21-22,34H,18-20H2
InChIKeyUIMMVOFPUTWUPA-UHFFFAOYSA-N
XLogP7.63
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.57
LogP ≤ 57.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2,6-di(butan-2-yl)-4-(9H-fluoren-1-yl)phenoxy]ethanol
CID 67661007
2-[4-(9H-fluoren-1-yl)-2-methylphenoxy]ethanol
CID 66730243
2-[3-(9H-fluoren-1-yl)-5-phenylphenyl]triphenylene;2-[3-(9H-fluoren-1-yl)phenyl]triphenylene;2-(9H-fluoren-1-yl)triphenylene;2-[3-(8-phenyl-9H-fluoren-1-yl)phenyl]triphenylene
CID 160799240
1-[2-(4-phenylphenyl)phenyl]-9H-fluorene
CID 174460318
4-[2-(9H-fluoren-1-yl)phenoxy]butan-1-ol
CID 151570912
2,11-bis(9H-fluoren-1-yl)triphenylene
CID 59489264
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
dibenzofuran;1-phenyl-9H-fluorene
CID 175545610
2,9-bis(9H-fluoren-1-yl)-4,7-diphenyl-1,10-phenanthroline
CID 69433443
9H-fluoren-4-amine;1-phenyl-9H-fluorene
CID 175396170
1-(9H-fluoren-1-yl)-2,3,4-triphenyl-9H-fluorene
CID 150664526
1-(3,5-dimethoxyphenyl)-9H-fluorene
CID 152594732

Frequently Asked Questions

What is the IUPAC name of 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol?
The IUPAC name of 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol (CID 67660456) is 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol.
What is the SMILES notation for 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol?
The canonical SMILES for 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol is OCCOc1c(-c2ccccc2)cc(-c2cccc3c2Cc2ccccc2-3)cc1-c1ccccc1.
What is the InChIKey of 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol?
The InChIKey is UIMMVOFPUTWUPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26O2/c34-18-19-35-33-30(23-10-3-1-4-11-23)21-26(22-31(33)24-12-5-2-6-13-24)28-16-9-17-29-27-15-8-7-14-25(27)20-32(28)29/h1-17,21-22,34H,18-20H2.
What are the key properties of 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol?
2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol has a molecular weight of 454.57 g/mol, XLogP of 7.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(9H-fluoren-1-yl)-2,6-diphenylphenoxy]ethanol is sourced from PubChem (CID 67660456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).