3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol

C25H22O — CID 87997584

IUPAC3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol
SMILESOCCCC1=CC(c2cccc3c2Cc2ccccc2-3)c2ccccc21
InChIInChI=1S/C25H22O/c26-14-6-8-18-16-24(21-11-4-3-10-20(18)21)23-13-5-12-22-19-9-2-1-7-17(19)15-25(22)23/h1-5,7,9-13,16,24,26H,6,8,14-15H2
InChIKeyJORBNMXXDYIAKV-UHFFFAOYSA-N
MW338.45 g/mol
LogP5.56
Rot. Bonds4

About 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol

3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol (PubChem CID 87997584) has the molecular formula C25H22O and a molecular weight of 338.45 g/mol. Its IUPAC name is 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol.

Molecular Properties

Compound Name3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol
PubChem CID87997584
Molecular FormulaC25H22O
Molecular Weight338.45 g/mol
Exact Mass338.17
IUPAC Name3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol
SMILESOCCCC1=CC(c2cccc3c2Cc2ccccc2-3)c2ccccc21
InChIInChI=1S/C25H22O/c26-14-6-8-18-16-24(21-11-4-3-10-20(18)21)23-13-5-12-22-19-9-2-1-7-17(19)15-25(22)23/h1-5,7,9-13,16,24,26H,6,8,14-15H2
InChIKeyJORBNMXXDYIAKV-UHFFFAOYSA-N
XLogP5.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.45
LogP ≤ 55.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

butane-1,4-diol;9H-fluorene
CID 158933795
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1-(3-hydroxypropyl)-9H-fluorene-2-carboxylic acid
CID 141108943
4-[2-(9H-fluoren-1-yl)phenoxy]butan-1-ol
CID 151570912
1-(4-propan-2-yl-1H-inden-1-yl)-9H-fluorene
CID 22910379
4-(9H-fluoren-1-yl)cyclohexan-1-amine
CID 150000864
2-[2-(9H-fluoren-1-yl)cyclopenta-1,4-dien-1-yl]ethanol
CID 23303814
3-[3-(2-ethylidenefluoren-1-yl)-3H-inden-1-yl]propan-1-ol
CID 87997559
1-[1-chloro-2,2-bis(9H-fluoren-1-yl)ethenyl]-9H-fluorene
CID 87814844
butane;1-methanidyl-9H-fluorene;uranium(2+)
CID 163676514
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
CID 87994766
CID 87994766

Frequently Asked Questions

What is the IUPAC name of 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol?
The IUPAC name of 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol (CID 87997584) is 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol.
What is the SMILES notation for 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol?
The canonical SMILES for 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol is OCCCC1=CC(c2cccc3c2Cc2ccccc2-3)c2ccccc21.
What is the InChIKey of 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol?
The InChIKey is JORBNMXXDYIAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22O/c26-14-6-8-18-16-24(21-11-4-3-10-20(18)21)23-13-5-12-22-19-9-2-1-7-17(19)15-25(22)23/h1-5,7,9-13,16,24,26H,6,8,14-15H2.
What are the key properties of 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol?
3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol has a molecular weight of 338.45 g/mol, XLogP of 5.56, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(9H-fluoren-1-yl)-3H-inden-1-yl]propan-1-ol is sourced from PubChem (CID 87997584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).