dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane

C34H32Si — CID 636162

IUPACdimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane
SMILESCC1=Cc2c(-c3ccccc3)cccc2C1[Si](C)(C)C1C(C)=Cc2c(-c3ccccc3)cccc21
InChIInChI=1S/C34H32Si/c1-23-21-31-27(25-13-7-5-8-14-25)17-11-19-29(31)33(23)35(3,4)34-24(2)22-32-28(18-12-20-30(32)34)26-15-9-6-10-16-26/h5-22,33-34H,1-4H3
InChIKeyOZIJRVRERJTEGQ-UHFFFAOYSA-N
MW468.72 g/mol
LogP9.51
Rot. Bonds4

About dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane

dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane (PubChem CID 636162) has the molecular formula C34H32Si and a molecular weight of 468.72 g/mol. Its IUPAC name is dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane.

Molecular Properties

Compound Namedimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane
PubChem CID636162
Molecular FormulaC34H32Si
Molecular Weight468.72 g/mol
Exact Mass468.23
IUPAC Namedimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane
SMILESCC1=Cc2c(-c3ccccc3)cccc2C1[Si](C)(C)C1C(C)=Cc2c(-c3ccccc3)cccc21
InChIInChI=1S/C34H32Si/c1-23-21-31-27(25-13-7-5-8-14-25)17-11-19-29(31)33(23)35(3,4)34-24(2)22-32-28(18-12-20-30(32)34)26-15-9-6-10-16-26/h5-22,33-34H,1-4H3
InChIKeyOZIJRVRERJTEGQ-UHFFFAOYSA-N
XLogP9.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.72
LogP ≤ 59.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane?
The IUPAC name of dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane (CID 636162) is dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane.
What is the SMILES notation for dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane?
The canonical SMILES for dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane is CC1=Cc2c(-c3ccccc3)cccc2C1[Si](C)(C)C1C(C)=Cc2c(-c3ccccc3)cccc21.
What is the InChIKey of dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane?
The InChIKey is OZIJRVRERJTEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H32Si/c1-23-21-31-27(25-13-7-5-8-14-25)17-11-19-29(31)33(23)35(3,4)34-24(2)22-32-28(18-12-20-30(32)34)26-15-9-6-10-16-26/h5-22,33-34H,1-4H3.
What are the key properties of dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane?
dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane has a molecular weight of 468.72 g/mol, XLogP of 9.51, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(2-methyl-4-phenyl-1H-inden-1-yl)silane is sourced from PubChem (CID 636162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).