4,7-diphenyl-1H-indene

C21H16 — CID 14940861

IUPAC4,7-diphenyl-1H-indene
SMILESC1=Cc2c(-c3ccccc3)ccc(-c3ccccc3)c2C1
InChIInChI=1S/C21H16/c1-3-8-16(9-4-1)18-14-15-19(17-10-5-2-6-11-17)21-13-7-12-20(18)21/h1-12,14-15H,13H2
InChIKeyAKHFVFALPIWERG-UHFFFAOYSA-N
MW268.36 g/mol
LogP5.59
Rot. Bonds2

About 4,7-diphenyl-1H-indene

4,7-diphenyl-1H-indene (PubChem CID 14940861) has the molecular formula C21H16 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4,7-diphenyl-1H-indene.

Molecular Properties

Compound Name4,7-diphenyl-1H-indene
PubChem CID14940861
Molecular FormulaC21H16
Molecular Weight268.36 g/mol
Exact Mass268.13
IUPAC Name4,7-diphenyl-1H-indene
SMILESC1=Cc2c(-c3ccccc3)ccc(-c3ccccc3)c2C1
InChIInChI=1S/C21H16/c1-3-8-16(9-4-1)18-14-15-19(17-10-5-2-6-11-17)21-13-7-12-20(18)21/h1-12,14-15H,13H2
InChIKeyAKHFVFALPIWERG-UHFFFAOYSA-N
XLogP5.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.36
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9-phenyl-10-(4-phenyl-5,6-dihydronaphthalen-1-yl)anthracene
CID 164717350
9-phenyl-10-(4-phenyl-7,8-dihydronaphthalen-1-yl)anthracene
CID 145174557
21-[10-(4-phenyl-5,6-dihydronaphthalen-1-yl)anthracen-9-yl]pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene
CID 166019929
4-(3,5-diphenylphenyl)-1H-indene
CID 22471910
1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene
CID 174368476
11-phenyl-5-(4-phenylnaphthalen-1-yl)-8H-cyclohepta[b]naphthalene
CID 144837253
3-methyl-6-[10-(4-phenyl-7,8-dihydronaphthalen-1-yl)anthracen-9-yl]benzene-1,2,4,5-tetrol
CID 145303264
5-fluoro-6-phenyl-1,2-dihydronaphthalene
CID 170408544
ethane;3-methyl-6-[10-(4-phenyl-7,8-dihydronaphthalen-1-yl)anthracen-9-yl]benzene-1,2,4,5-tetrol
CID 145303263
2-(2,2-dimethylpropyl)-4,7-diphenyl-1H-indene
CID 173016314
9,10-diphenyl-1,4-dihydroanthracene
CID 134158866
4-(1-chloro-5H-cyclopenta[c]pyridin-4-yl)benzaldehyde
CID 161146080

Frequently Asked Questions

What is the IUPAC name of 4,7-diphenyl-1H-indene?
The IUPAC name of 4,7-diphenyl-1H-indene (CID 14940861) is 4,7-diphenyl-1H-indene.
What is the SMILES notation for 4,7-diphenyl-1H-indene?
The canonical SMILES for 4,7-diphenyl-1H-indene is C1=Cc2c(-c3ccccc3)ccc(-c3ccccc3)c2C1.
What is the InChIKey of 4,7-diphenyl-1H-indene?
The InChIKey is AKHFVFALPIWERG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16/c1-3-8-16(9-4-1)18-14-15-19(17-10-5-2-6-11-17)21-13-7-12-20(18)21/h1-12,14-15H,13H2.
What are the key properties of 4,7-diphenyl-1H-indene?
4,7-diphenyl-1H-indene has a molecular weight of 268.36 g/mol, XLogP of 5.59, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-diphenyl-1H-indene is sourced from PubChem (CID 14940861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).