[(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane

C22H28Si — CID 10018944

IUPAC[(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane
SMILESCC1(C)C=C(C(c2ccccc2)[Si](C)(C)c2ccccc2)CC1
InChIInChI=1S/C22H28Si/c1-22(2)16-15-19(17-22)21(18-11-7-5-8-12-18)23(3,4)20-13-9-6-10-14-20/h5-14,17,21H,15-16H2,1-4H3
InChIKeyVKMSIVNYRDVFDT-UHFFFAOYSA-N
MW320.55 g/mol
LogP5.67
Rot. Bonds4

About [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane

[(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane (PubChem CID 10018944) has the molecular formula C22H28Si and a molecular weight of 320.55 g/mol. Its IUPAC name is [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane.

Molecular Properties

Compound Name[(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane
PubChem CID10018944
Molecular FormulaC22H28Si
Molecular Weight320.55 g/mol
Exact Mass320.20
IUPAC Name[(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane
SMILESCC1(C)C=C(C(c2ccccc2)[Si](C)(C)c2ccccc2)CC1
InChIInChI=1S/C22H28Si/c1-22(2)16-15-19(17-22)21(18-11-7-5-8-12-18)23(3,4)20-13-9-6-10-14-20/h5-14,17,21H,15-16H2,1-4H3
InChIKeyVKMSIVNYRDVFDT-UHFFFAOYSA-N
XLogP5.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.55
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Dimethyldiphenylmethane
CID 13065
Isopropylbiphenyl
CID 20259910
Trimethylbenzylsilane
CID 69862
[(E)-4-phenylbut-2-enyl]benzene
CID 5370638
alpha-Methylstyrene dimer
CID 22521
1,3-Diphenylpropane
CID 14125
1,4-Diphenylbutane
CID 66182
1,1,1-Triphenylethane
CID 78926
1,1'-(1,1-Dimethyl-3-methylene-1,3-propanediyl)bisbenzene
CID 80715
Benzene, 1,1'-(1,1,2,2-tetramethyl-1,2-ethanediyl)bis-
CID 74681
6,6'-Diphenylfulvene
CID 101236
Benzene, ethyl(phenylethyl)-, mono-ar-ethyl deriv.
CID 521817

Frequently Asked Questions

What is the IUPAC name of [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane?
The IUPAC name of [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane (CID 10018944) is [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane.
What is the SMILES notation for [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane?
The canonical SMILES for [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane is CC1(C)C=C(C(c2ccccc2)[Si](C)(C)c2ccccc2)CC1.
What is the InChIKey of [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane?
The InChIKey is VKMSIVNYRDVFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28Si/c1-22(2)16-15-19(17-22)21(18-11-7-5-8-12-18)23(3,4)20-13-9-6-10-14-20/h5-14,17,21H,15-16H2,1-4H3.
What are the key properties of [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane?
[(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane has a molecular weight of 320.55 g/mol, XLogP of 5.67, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,3-dimethylcyclopenten-1-yl)-phenylmethyl]-dimethyl-phenylsilane is sourced from PubChem (CID 10018944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).