chloro-tris(2-methyl-1H-inden-1-yl)silane

C30H27ClSi — CID 54305128

IUPACchloro-tris(2-methyl-1H-inden-1-yl)silane
SMILESCC1=Cc2ccccc2C1[Si](Cl)(C1C(C)=Cc2ccccc21)C1C(C)=Cc2ccccc21
InChIInChI=1S/C30H27ClSi/c1-19-16-22-10-4-7-13-25(22)28(19)32(31,29-20(2)17-23-11-5-8-14-26(23)29)30-21(3)18-24-12-6-9-15-27(24)30/h4-18,28-30H,1-3H3
InChIKeySGYKWJKSLCWKSJ-UHFFFAOYSA-N
MW451.09 g/mol
LogP8.39
Rot. Bonds3

About chloro-tris(2-methyl-1H-inden-1-yl)silane

chloro-tris(2-methyl-1H-inden-1-yl)silane (PubChem CID 54305128) has the molecular formula C30H27ClSi and a molecular weight of 451.09 g/mol. Its IUPAC name is chloro-tris(2-methyl-1H-inden-1-yl)silane.

Molecular Properties

Compound Namechloro-tris(2-methyl-1H-inden-1-yl)silane
PubChem CID54305128
Molecular FormulaC30H27ClSi
Molecular Weight451.09 g/mol
Exact Mass450.16
IUPAC Namechloro-tris(2-methyl-1H-inden-1-yl)silane
SMILESCC1=Cc2ccccc2C1[Si](Cl)(C1C(C)=Cc2ccccc21)C1C(C)=Cc2ccccc21
InChIInChI=1S/C30H27ClSi/c1-19-16-22-10-4-7-13-25(22)28(19)32(31,29-20(2)17-23-11-5-8-14-26(23)29)30-21(3)18-24-12-6-9-15-27(24)30/h4-18,28-30H,1-3H3
InChIKeySGYKWJKSLCWKSJ-UHFFFAOYSA-N
XLogP8.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.09
LogP ≤ 58.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tetrakis(2-methyl-1H-inden-1-yl)silane
CID 54395226
chloro-bis(2-methyl-1H-inden-1-yl)-phenylsilane
CID 54510679
[dimethyl-(2-methyl-1H-inden-1-yl)silyl]-dimethyl-(2-methyl-1H-inden-1-yl)silane
CID 100983121
trimethyl-[(1S)-2-methyl-1H-inden-1-yl]silane
CID 99738416
(2-methoxyphenyl)-dimethyl-(2-methyl-1H-inden-1-yl)silane
CID 139784658
bis(2-methyl-1H-inden-1-yl)silane
CID 154500398
1-methanidyl-2-methyl-1H-indene;zirconium
CID 173317989
(4-cyclohexyl-2-methyl-1H-inden-1-yl)-dimethyl-(2-methyl-1H-inden-1-yl)silane
CID 67039854
butyl-methyl-(2-methyl-1H-inden-1-yl)-(2,4,6-trimethylphenyl)silane
CID 88592987
N-[dimethyl-(2-methyl-1H-inden-1-yl)silyl]-2-methylpropan-2-amine;(2E,4E)-hexa-2,4-diene
CID 140997986
1-ethyl-2-methyl-1H-indene
CID 12910549
dimethyl-(2-methyl-3aH-inden-1-yl)-(2-methyl-1H-inden-1-yl)silane
CID 20609622

Frequently Asked Questions

What is the IUPAC name of chloro-tris(2-methyl-1H-inden-1-yl)silane?
The IUPAC name of chloro-tris(2-methyl-1H-inden-1-yl)silane (CID 54305128) is chloro-tris(2-methyl-1H-inden-1-yl)silane.
What is the SMILES notation for chloro-tris(2-methyl-1H-inden-1-yl)silane?
The canonical SMILES for chloro-tris(2-methyl-1H-inden-1-yl)silane is CC1=Cc2ccccc2C1[Si](Cl)(C1C(C)=Cc2ccccc21)C1C(C)=Cc2ccccc21.
What is the InChIKey of chloro-tris(2-methyl-1H-inden-1-yl)silane?
The InChIKey is SGYKWJKSLCWKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27ClSi/c1-19-16-22-10-4-7-13-25(22)28(19)32(31,29-20(2)17-23-11-5-8-14-26(23)29)30-21(3)18-24-12-6-9-15-27(24)30/h4-18,28-30H,1-3H3.
What are the key properties of chloro-tris(2-methyl-1H-inden-1-yl)silane?
chloro-tris(2-methyl-1H-inden-1-yl)silane has a molecular weight of 451.09 g/mol, XLogP of 8.39, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-tris(2-methyl-1H-inden-1-yl)silane is sourced from PubChem (CID 54305128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).