bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane

C24H28O2Si — CID 139707691

IUPACbis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane
SMILESCOc1ccc([Si](C)(C)c2ccc(OC)c3c2CC=C3C)c2c1C(C)=CC2
InChIInChI=1S/C24H28O2Si/c1-15-7-9-17-21(13-11-19(25-3)23(15)17)27(5,6)22-14-12-20(26-4)24-16(2)8-10-18(22)24/h7-8,11-14H,9-10H2,1-6H3
InChIKeyCSZREYSDFMZLBF-UHFFFAOYSA-N
MW376.57 g/mol
LogP4.45
Rot. Bonds4

About bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane

bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane (PubChem CID 139707691) has the molecular formula C24H28O2Si and a molecular weight of 376.57 g/mol. Its IUPAC name is bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane.

Molecular Properties

Compound Namebis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane
PubChem CID139707691
Molecular FormulaC24H28O2Si
Molecular Weight376.57 g/mol
Exact Mass376.19
IUPAC Namebis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane
SMILESCOc1ccc([Si](C)(C)c2ccc(OC)c3c2CC=C3C)c2c1C(C)=CC2
InChIInChI=1S/C24H28O2Si/c1-15-7-9-17-21(13-11-19(25-3)23(15)17)27(5,6)22-14-12-20(26-4)24-16(2)8-10-18(22)24/h7-8,11-14H,9-10H2,1-6H3
InChIKeyCSZREYSDFMZLBF-UHFFFAOYSA-N
XLogP4.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.57
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane?
The IUPAC name of bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane (CID 139707691) is bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane.
What is the SMILES notation for bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane?
The canonical SMILES for bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane is COc1ccc([Si](C)(C)c2ccc(OC)c3c2CC=C3C)c2c1C(C)=CC2.
What is the InChIKey of bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane?
The InChIKey is CSZREYSDFMZLBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28O2Si/c1-15-7-9-17-21(13-11-19(25-3)23(15)17)27(5,6)22-14-12-20(26-4)24-16(2)8-10-18(22)24/h7-8,11-14H,9-10H2,1-6H3.
What are the key properties of bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane?
bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane has a molecular weight of 376.57 g/mol, XLogP of 4.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(7-methoxy-1-methyl-3H-inden-4-yl)-dimethylsilane is sourced from PubChem (CID 139707691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).