1-[3-(1H-inden-1-yl)phenyl]-1H-indene

C24H18 — CID 15872860

IUPAC1-[3-(1H-inden-1-yl)phenyl]-1H-indene
SMILESC1=CC(c2cccc(C3C=Cc4ccccc43)c2)c2ccccc21
InChIInChI=1S/C24H18/c1-3-10-21-17(6-1)12-14-23(21)19-8-5-9-20(16-19)24-15-13-18-7-2-4-11-22(18)24/h1-16,23-24H
InChIKeyCGLNPNUAVLYRDP-UHFFFAOYSA-N
MW306.41 g/mol
LogP6.00
Rot. Bonds2

About 1-[3-(1H-inden-1-yl)phenyl]-1H-indene

1-[3-(1H-inden-1-yl)phenyl]-1H-indene (PubChem CID 15872860) has the molecular formula C24H18 and a molecular weight of 306.41 g/mol. Its IUPAC name is 1-[3-(1H-inden-1-yl)phenyl]-1H-indene.

Molecular Properties

Compound Name1-[3-(1H-inden-1-yl)phenyl]-1H-indene
PubChem CID15872860
Molecular FormulaC24H18
Molecular Weight306.41 g/mol
Exact Mass306.14
IUPAC Name1-[3-(1H-inden-1-yl)phenyl]-1H-indene
SMILESC1=CC(c2cccc(C3C=Cc4ccccc43)c2)c2ccccc21
InChIInChI=1S/C24H18/c1-3-10-21-17(6-1)12-14-23(21)19-8-5-9-20(16-19)24-15-13-18-7-2-4-11-22(18)24/h1-16,23-24H
InChIKeyCGLNPNUAVLYRDP-UHFFFAOYSA-N
XLogP6.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.41
LogP ≤ 56.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(1H-inden-1-yl)phenyl]-1H-indene?
The IUPAC name of 1-[3-(1H-inden-1-yl)phenyl]-1H-indene (CID 15872860) is 1-[3-(1H-inden-1-yl)phenyl]-1H-indene.
What is the SMILES notation for 1-[3-(1H-inden-1-yl)phenyl]-1H-indene?
The canonical SMILES for 1-[3-(1H-inden-1-yl)phenyl]-1H-indene is C1=CC(c2cccc(C3C=Cc4ccccc43)c2)c2ccccc21.
What is the InChIKey of 1-[3-(1H-inden-1-yl)phenyl]-1H-indene?
The InChIKey is CGLNPNUAVLYRDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18/c1-3-10-21-17(6-1)12-14-23(21)19-8-5-9-20(16-19)24-15-13-18-7-2-4-11-22(18)24/h1-16,23-24H.
What are the key properties of 1-[3-(1H-inden-1-yl)phenyl]-1H-indene?
1-[3-(1H-inden-1-yl)phenyl]-1H-indene has a molecular weight of 306.41 g/mol, XLogP of 6.00, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(1H-inden-1-yl)phenyl]-1H-indene is sourced from PubChem (CID 15872860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).