(2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane

C36H34Si — CID 139774717

IUPAC(2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=CC(C)=C(C)C1[Si](c1ccccc1)(c1ccccc1)C1C(C)=Cc2c(-c3ccccc3)cccc21
InChIInChI=1S/C36H34Si/c1-25-23-26(2)35(28(25)4)37(30-17-10-6-11-18-30,31-19-12-7-13-20-31)36-27(3)24-34-32(21-14-22-33(34)36)29-15-8-5-9-16-29/h5-24,35-36H,1-4H3
InChIKeyISDYNFJODYOWGJ-UHFFFAOYSA-N
MW494.75 g/mol
LogP8.32
Rot. Bonds5

About (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane

(2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 139774717) has the molecular formula C36H34Si and a molecular weight of 494.75 g/mol. Its IUPAC name is (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Name(2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane
PubChem CID139774717
Molecular FormulaC36H34Si
Molecular Weight494.75 g/mol
Exact Mass494.24
IUPAC Name(2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=CC(C)=C(C)C1[Si](c1ccccc1)(c1ccccc1)C1C(C)=Cc2c(-c3ccccc3)cccc21
InChIInChI=1S/C36H34Si/c1-25-23-26(2)35(28(25)4)37(30-17-10-6-11-18-30,31-19-12-7-13-20-31)36-27(3)24-34-32(21-14-22-33(34)36)29-15-8-5-9-16-29/h5-24,35-36H,1-4H3
InChIKeyISDYNFJODYOWGJ-UHFFFAOYSA-N
XLogP8.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.75
LogP ≤ 58.32
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

dimethyl-bis[(1R)-2-methyl-4-phenyl-1H-inden-1-yl]silane
CID 101111754
bis(2-methyl-4-propyl-1H-inden-1-yl)-diphenylsilane
CID 154364351
triphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane
CID 140852226
(3-tert-butylcyclopenta-1,3-dien-1-yl)-dimethyl-(2-methyl-4-phenyl-1H-inden-1-yl)silane
CID 139716355
chloro-methyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)-phenylsilane
CID 57186607
(2-methyl-1H-inden-1-yl)-(5,5,8,8,16,16,19,19-octamethyl-12-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),10,13,15(20)-hexaenyl)-diphenylsilane
CID 102398548
CID 69304218
CID 69304218
dimethyl-bis(2-methyl-8-phenyl-3H-cyclopenta[b][1]benzothiol-3-yl)silane
CID 68999609
bis[4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-1H-inden-1-yl]-dimethylsilane
CID 12009760
N,N-diethyl-2-(2-methyl-4-phenyl-1H-inden-1-yl)aniline
CID 155667322
CID 173305494
CID 173305494
(2-ethyl-4-phenyl-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silane
CID 140672926

Frequently Asked Questions

What is the IUPAC name of (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane (CID 139774717) is (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane is CC1=CC(C)=C(C)C1[Si](c1ccccc1)(c1ccccc1)C1C(C)=Cc2c(-c3ccccc3)cccc21.
What is the InChIKey of (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is ISDYNFJODYOWGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H34Si/c1-25-23-26(2)35(28(25)4)37(30-17-10-6-11-18-30,31-19-12-7-13-20-31)36-27(3)24-34-32(21-14-22-33(34)36)29-15-8-5-9-16-29/h5-24,35-36H,1-4H3.
What are the key properties of (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane?
(2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane has a molecular weight of 494.75 g/mol, XLogP of 8.32, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 139774717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).