1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene

C38H26 — CID 150323539

IUPAC1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene
SMILESc1ccc(-c2cc3c(c(C4c5ccccc5-c5ccccc54)c2-c2ccccc2)Cc2ccccc2-3)cc1
InChIInChI=1S/C38H26/c1-3-13-25(14-4-1)33-24-34-28-18-8-7-17-27(28)23-35(34)38(36(33)26-15-5-2-6-16-26)37-31-21-11-9-19-29(31)30-20-10-12-22-32(30)37/h1-22,24,37H,23H2
InChIKeyGODKNESDYBBNFO-UHFFFAOYSA-N
MW482.63 g/mol
LogP9.75
Rot. Bonds3

About 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene

1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene (PubChem CID 150323539) has the molecular formula C38H26 and a molecular weight of 482.63 g/mol. Its IUPAC name is 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene.

Molecular Properties

Compound Name1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene
PubChem CID150323539
Molecular FormulaC38H26
Molecular Weight482.63 g/mol
Exact Mass482.20
IUPAC Name1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene
SMILESc1ccc(-c2cc3c(c(C4c5ccccc5-c5ccccc54)c2-c2ccccc2)Cc2ccccc2-3)cc1
InChIInChI=1S/C38H26/c1-3-13-25(14-4-1)33-24-34-28-18-8-7-17-27(28)23-35(34)38(36(33)26-15-5-2-6-16-26)37-31-21-11-9-19-29(31)30-20-10-12-22-32(30)37/h1-22,24,37H,23H2
InChIKeyGODKNESDYBBNFO-UHFFFAOYSA-N
XLogP9.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms38
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.63
LogP ≤ 59.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene?
The IUPAC name of 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene (CID 150323539) is 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene.
What is the SMILES notation for 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene?
The canonical SMILES for 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene is c1ccc(-c2cc3c(c(C4c5ccccc5-c5ccccc54)c2-c2ccccc2)Cc2ccccc2-3)cc1.
What is the InChIKey of 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene?
The InChIKey is GODKNESDYBBNFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26/c1-3-13-25(14-4-1)33-24-34-28-18-8-7-17-27(28)23-35(34)38(36(33)26-15-5-2-6-16-26)37-31-21-11-9-19-29(31)30-20-10-12-22-32(30)37/h1-22,24,37H,23H2.
What are the key properties of 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene?
1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene has a molecular weight of 482.63 g/mol, XLogP of 9.75, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene is sourced from PubChem (CID 150323539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).