diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane

C28H34Si — CID 153307772

IUPACdiethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC[Si](CC)(C1C(C)=C(C)C(C)=C1C)C1C=C(c2ccccc2)c2ccccc21
InChIInChI=1S/C28H34Si/c1-7-29(8-2,28-21(5)19(3)20(4)22(28)6)27-18-26(23-14-10-9-11-15-23)24-16-12-13-17-25(24)27/h9-18,27-28H,7-8H2,1-6H3
InChIKeyJYXCVJQGSBUOID-UHFFFAOYSA-N
MW398.67 g/mol
LogP8.30
Rot. Bonds5

About diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane

diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 153307772) has the molecular formula C28H34Si and a molecular weight of 398.67 g/mol. Its IUPAC name is diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Namediethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
PubChem CID153307772
Molecular FormulaC28H34Si
Molecular Weight398.67 g/mol
Exact Mass398.24
IUPAC Namediethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC[Si](CC)(C1C(C)=C(C)C(C)=C1C)C1C=C(c2ccccc2)c2ccccc21
InChIInChI=1S/C28H34Si/c1-7-29(8-2,28-21(5)19(3)20(4)22(28)6)27-18-26(23-14-10-9-11-15-23)24-16-12-13-17-25(24)27/h9-18,27-28H,7-8H2,1-6H3
InChIKeyJYXCVJQGSBUOID-UHFFFAOYSA-N
XLogP8.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.67
LogP ≤ 58.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

diethyl-(3-methyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
CID 153307768
3-(4-ethylphenyl)-1-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)-1H-indene
CID 174900858
CID 87518738
CID 87518738
bis(3-chloro-2-methyl-1H-inden-1-yl)-diethylsilane
CID 141235174
3-(4-butylphenyl)-1-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)-1H-indene
CID 174900861
1-(2-methylpropyl)-3-phenyl-1H-indene
CID 163497952
(2,3-dimethyl-1H-inden-1-yl)-trimethylsilane
CID 18766748
1-ethynyl-3-phenyl-1H-indene
CID 142456499
dimethyl-(2-methyl-3-propyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
CID 158268305
(1S)-1-phenoxy-3-phenyl-1H-indene
CID 7055915
ethane;propane;1,2,3-trimethyl-1H-indene
CID 142448762
diethyl-bis(4-phenyl-2-propan-2-ylcyclopenta-2,4-dien-1-yl)silane
CID 139672592

Frequently Asked Questions

What is the IUPAC name of diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane (CID 153307772) is diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane is CC[Si](CC)(C1C(C)=C(C)C(C)=C1C)C1C=C(c2ccccc2)c2ccccc21.
What is the InChIKey of diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is JYXCVJQGSBUOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H34Si/c1-7-29(8-2,28-21(5)19(3)20(4)22(28)6)27-18-26(23-14-10-9-11-15-23)24-16-12-13-17-25(24)27/h9-18,27-28H,7-8H2,1-6H3.
What are the key properties of diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane has a molecular weight of 398.67 g/mol, XLogP of 8.30, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(3-phenyl-1H-inden-1-yl)-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 153307772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).