[(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene

C26H24 — CID 141345973

IUPAC[(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene
SMILESCC1=CC(C(c2ccccc2)(c2ccccc2)c2ccccc2)C=C1C
InChIInChI=1S/C26H24/c1-20-18-25(19-21(20)2)26(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-19,25H,1-2H3
InChIKeyFJKXNWDAAPNLEX-UHFFFAOYSA-N
MW336.48 g/mol
LogP6.54
Rot. Bonds4

About [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene

[(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene (PubChem CID 141345973) has the molecular formula C26H24 and a molecular weight of 336.48 g/mol. Its IUPAC name is [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene.

Molecular Properties

Compound Name[(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene
PubChem CID141345973
Molecular FormulaC26H24
Molecular Weight336.48 g/mol
Exact Mass336.19
IUPAC Name[(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene
SMILESCC1=CC(C(c2ccccc2)(c2ccccc2)c2ccccc2)C=C1C
InChIInChI=1S/C26H24/c1-20-18-25(19-21(20)2)26(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-19,25H,1-2H3
InChIKeyFJKXNWDAAPNLEX-UHFFFAOYSA-N
XLogP6.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.48
LogP ≤ 56.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

1-[(3,4-dimethylcyclopenta-2,4-dien-1-yl)-bis(3-methylphenyl)methyl]-3-methylbenzene
CID 157132628
9-[cyclopentyl(diphenyl)methyl]-2,3,6,7-tetramethyl-4b,8a,9,9a-tetrahydro-4aH-fluorene
CID 140850336
(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)benzene
CID 141345975
2-phenylpropan-2-ylbenzene
CID 13065
CID 171375456
CID 171375456
1-[cyclohexyl-(4-methylphenyl)-phenylmethyl]-4-phenylbenzene
CID 143707750
tert-butylbenzene;1,3,5-trimethylbenzene
CID 173429948
tris(tert-butylbenzene);ethane;toluene
CID 158234120
1-methyl-4-[(4-methylphenyl)-diphenylmethyl]benzene
CID 22957062
tert-butylbenzene;chloromethane;ethane
CID 91149652
benzene;tert-butylbenzene;bis(2,2-dimethylpropane);ethane
CID 158670454
tert-butylbenzene;2,2-dimethylpropane;methane
CID 160959011

Frequently Asked Questions

What is the IUPAC name of [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene?
The IUPAC name of [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene (CID 141345973) is [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene.
What is the SMILES notation for [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene?
The canonical SMILES for [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene is CC1=CC(C(c2ccccc2)(c2ccccc2)c2ccccc2)C=C1C.
What is the InChIKey of [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene?
The InChIKey is FJKXNWDAAPNLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24/c1-20-18-25(19-21(20)2)26(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-19,25H,1-2H3.
What are the key properties of [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene?
[(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene has a molecular weight of 336.48 g/mol, XLogP of 6.54, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-dimethylcyclopenta-2,4-dien-1-yl)-diphenylmethyl]benzene is sourced from PubChem (CID 141345973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).