2'-phenylspiro[1,3-dihydroindene-2,1'-indene]

C23H18 — CID 22600576

IUPAC2'-phenylspiro[1,3-dihydroindene-2,1'-indene]
SMILESC1=C(c2ccccc2)C2(Cc3ccccc3C2)c2ccccc21
InChIInChI=1S/C23H18/c1-2-8-17(9-3-1)22-14-18-10-6-7-13-21(18)23(22)15-19-11-4-5-12-20(19)16-23/h1-14H,15-16H2
InChIKeyJDAYHXPHXPCKKX-UHFFFAOYSA-N
MW294.40 g/mol
LogP5.28
Rot. Bonds1

About 2'-phenylspiro[1,3-dihydroindene-2,1'-indene]

2'-phenylspiro[1,3-dihydroindene-2,1'-indene] (PubChem CID 22600576) has the molecular formula C23H18 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2'-phenylspiro[1,3-dihydroindene-2,1'-indene].

Molecular Properties

Compound Name2'-phenylspiro[1,3-dihydroindene-2,1'-indene]
PubChem CID22600576
Molecular FormulaC23H18
Molecular Weight294.40 g/mol
Exact Mass294.14
IUPAC Name2'-phenylspiro[1,3-dihydroindene-2,1'-indene]
SMILESC1=C(c2ccccc2)C2(Cc3ccccc3C2)c2ccccc21
InChIInChI=1S/C23H18/c1-2-8-17(9-3-1)22-14-18-10-6-7-13-21(18)23(22)15-19-11-4-5-12-20(19)16-23/h1-14H,15-16H2
InChIKeyJDAYHXPHXPCKKX-UHFFFAOYSA-N
XLogP5.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.40
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2'-phenylspiro[1,3-dihydroindene-2,1'-indene]?
The IUPAC name of 2'-phenylspiro[1,3-dihydroindene-2,1'-indene] (CID 22600576) is 2'-phenylspiro[1,3-dihydroindene-2,1'-indene].
What is the SMILES notation for 2'-phenylspiro[1,3-dihydroindene-2,1'-indene]?
The canonical SMILES for 2'-phenylspiro[1,3-dihydroindene-2,1'-indene] is C1=C(c2ccccc2)C2(Cc3ccccc3C2)c2ccccc21.
What is the InChIKey of 2'-phenylspiro[1,3-dihydroindene-2,1'-indene]?
The InChIKey is JDAYHXPHXPCKKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18/c1-2-8-17(9-3-1)22-14-18-10-6-7-13-21(18)23(22)15-19-11-4-5-12-20(19)16-23/h1-14H,15-16H2.
What are the key properties of 2'-phenylspiro[1,3-dihydroindene-2,1'-indene]?
2'-phenylspiro[1,3-dihydroindene-2,1'-indene] has a molecular weight of 294.40 g/mol, XLogP of 5.28, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-phenylspiro[1,3-dihydroindene-2,1'-indene] is sourced from PubChem (CID 22600576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).