2-[3-(1H-inden-2-yl)phenyl]-1H-indene

C24H18 — CID 159714267

IUPAC2-[3-(1H-inden-2-yl)phenyl]-1H-indene
SMILESC1=C(c2cccc(C3=Cc4ccccc4C3)c2)Cc2ccccc21
InChIInChI=1S/C24H18/c1-2-7-18-14-23(13-17(18)6-1)21-10-5-11-22(12-21)24-15-19-8-3-4-9-20(19)16-24/h1-13,15H,14,16H2
InChIKeyGKGRPCYLXPJFBF-UHFFFAOYSA-N
MW306.41 g/mol
LogP5.88
Rot. Bonds2

About 2-[3-(1H-inden-2-yl)phenyl]-1H-indene

2-[3-(1H-inden-2-yl)phenyl]-1H-indene (PubChem CID 159714267) has the molecular formula C24H18 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-[3-(1H-inden-2-yl)phenyl]-1H-indene.

Molecular Properties

Compound Name2-[3-(1H-inden-2-yl)phenyl]-1H-indene
PubChem CID159714267
Molecular FormulaC24H18
Molecular Weight306.41 g/mol
Exact Mass306.14
IUPAC Name2-[3-(1H-inden-2-yl)phenyl]-1H-indene
SMILESC1=C(c2cccc(C3=Cc4ccccc4C3)c2)Cc2ccccc21
InChIInChI=1S/C24H18/c1-2-7-18-14-23(13-17(18)6-1)21-10-5-11-22(12-21)24-15-19-8-3-4-9-20(19)16-24/h1-13,15H,14,16H2
InChIKeyGKGRPCYLXPJFBF-UHFFFAOYSA-N
XLogP5.88
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 ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

2-(4-phenylphenyl)-1H-indene;zirconium
CID 174373323
3-(1H-inden-2-yl)-N,N-dimethylaniline
CID 86066545
9-(3-bromophenyl)tricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,8,11,13-heptaene
CID 145377281
2,5-diphenyl-1H-indene;zirconium(2+);dichloride
CID 175286821
2-[4-(trifluoromethyl)phenyl]-1H-indene;zirconium
CID 174374188
2-(3,5-ditert-butylphenyl)-1H-indene;dichlorozirconium
CID 174234442
2-(1H-inden-2-yl)furan;zirconium
CID 174544021
CID 143131255
CID 143131255
2-(6-cyclopenta-1,3-dien-1-yl-1H-inden-2-yl)-9H-fluorene
CID 155571314
1-[[4-[4-(1H-inden-2-yl)phenyl]phenyl]-phenylmethyl]naphthalene
CID 58568788
2-(3-fluorophenyl)-6-methoxy-1H-indene
CID 18518306
4-[9-[3-(1H-inden-2-yl)-5-phenylphenyl]carbazol-4-yl]-9-naphthalen-2-ylcarbazole
CID 138474926

Frequently Asked Questions

What is the IUPAC name of 2-[3-(1H-inden-2-yl)phenyl]-1H-indene?
The IUPAC name of 2-[3-(1H-inden-2-yl)phenyl]-1H-indene (CID 159714267) is 2-[3-(1H-inden-2-yl)phenyl]-1H-indene.
What is the SMILES notation for 2-[3-(1H-inden-2-yl)phenyl]-1H-indene?
The canonical SMILES for 2-[3-(1H-inden-2-yl)phenyl]-1H-indene is C1=C(c2cccc(C3=Cc4ccccc4C3)c2)Cc2ccccc21.
What is the InChIKey of 2-[3-(1H-inden-2-yl)phenyl]-1H-indene?
The InChIKey is GKGRPCYLXPJFBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18/c1-2-7-18-14-23(13-17(18)6-1)21-10-5-11-22(12-21)24-15-19-8-3-4-9-20(19)16-24/h1-13,15H,14,16H2.
What are the key properties of 2-[3-(1H-inden-2-yl)phenyl]-1H-indene?
2-[3-(1H-inden-2-yl)phenyl]-1H-indene has a molecular weight of 306.41 g/mol, XLogP of 5.88, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(1H-inden-2-yl)phenyl]-1H-indene is sourced from PubChem (CID 159714267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).