1-(9H-fluoren-1-yl)-9H-fluorene

C26H18 — CID 19077838

IUPAC1-(9H-fluoren-1-yl)-9H-fluorene
SMILESc1ccc2c(c1)Cc1c-2cccc1-c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C26H18/c1-3-9-19-17(7-1)15-25-21(19)11-5-13-23(25)24-14-6-12-22-20-10-4-2-8-18(20)16-26(22)24/h1-14H,15-16H2
InChIKeyPVBKQYOOKXZUNU-UHFFFAOYSA-N
MW330.43 g/mol
LogP6.50
Rot. Bonds1

About 1-(9H-fluoren-1-yl)-9H-fluorene

1-(9H-fluoren-1-yl)-9H-fluorene (PubChem CID 19077838) has the molecular formula C26H18 and a molecular weight of 330.43 g/mol. Its IUPAC name is 1-(9H-fluoren-1-yl)-9H-fluorene.

Molecular Properties

Compound Name1-(9H-fluoren-1-yl)-9H-fluorene
PubChem CID19077838
Molecular FormulaC26H18
Molecular Weight330.43 g/mol
Exact Mass330.14
IUPAC Name1-(9H-fluoren-1-yl)-9H-fluorene
SMILESc1ccc2c(c1)Cc1c-2cccc1-c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C26H18/c1-3-9-19-17(7-1)15-25-21(19)11-5-13-23(25)24-14-6-12-22-20-10-4-2-8-18(20)16-26(22)24/h1-14H,15-16H2
InChIKeyPVBKQYOOKXZUNU-UHFFFAOYSA-N
XLogP6.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.43
LogP ≤ 56.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(9H-fluoren-1-yl)-9H-fluorene?
The IUPAC name of 1-(9H-fluoren-1-yl)-9H-fluorene (CID 19077838) is 1-(9H-fluoren-1-yl)-9H-fluorene.
What is the SMILES notation for 1-(9H-fluoren-1-yl)-9H-fluorene?
The canonical SMILES for 1-(9H-fluoren-1-yl)-9H-fluorene is c1ccc2c(c1)Cc1c-2cccc1-c1cccc2c1Cc1ccccc1-2.
What is the InChIKey of 1-(9H-fluoren-1-yl)-9H-fluorene?
The InChIKey is PVBKQYOOKXZUNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18/c1-3-9-19-17(7-1)15-25-21(19)11-5-13-23(25)24-14-6-12-22-20-10-4-2-8-18(20)16-26(22)24/h1-14H,15-16H2.
What are the key properties of 1-(9H-fluoren-1-yl)-9H-fluorene?
1-(9H-fluoren-1-yl)-9H-fluorene has a molecular weight of 330.43 g/mol, XLogP of 6.50, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-1-yl)-9H-fluorene is sourced from PubChem (CID 19077838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).