chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane

C24H27ClSi2 — CID 163422359

IUPACchloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane
SMILESCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Si](C)(C)[Si](C)(C)Cl
InChIInChI=1S/C24H27ClSi2/c1-17-16-23-21(20-13-8-11-18-10-6-7-12-19(18)20)14-9-15-22(23)24(17)26(2,3)27(4,5)25/h6-16,24H,1-5H3
InChIKeyAJMVXOKYLILBFK-UHFFFAOYSA-N
MW407.11 g/mol
LogP7.78
Rot. Bonds3

About chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane

chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane (PubChem CID 163422359) has the molecular formula C24H27ClSi2 and a molecular weight of 407.11 g/mol. Its IUPAC name is chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane.

Molecular Properties

Compound Namechloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane
PubChem CID163422359
Molecular FormulaC24H27ClSi2
Molecular Weight407.11 g/mol
Exact Mass406.13
IUPAC Namechloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane
SMILESCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Si](C)(C)[Si](C)(C)Cl
InChIInChI=1S/C24H27ClSi2/c1-17-16-23-21(20-13-8-11-18-10-6-7-12-19(18)20)14-9-15-22(23)24(17)26(2,3)27(4,5)25/h6-16,24H,1-5H3
InChIKeyAJMVXOKYLILBFK-UHFFFAOYSA-N
XLogP7.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.11
LogP ≤ 57.78
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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Frequently Asked Questions

What is the IUPAC name of chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane?
The IUPAC name of chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane (CID 163422359) is chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane.
What is the SMILES notation for chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane?
The canonical SMILES for chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane is CC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Si](C)(C)[Si](C)(C)Cl.
What is the InChIKey of chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane?
The InChIKey is AJMVXOKYLILBFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27ClSi2/c1-17-16-23-21(20-13-8-11-18-10-6-7-12-19(18)20)14-9-15-22(23)24(17)26(2,3)27(4,5)25/h6-16,24H,1-5H3.
What are the key properties of chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane?
chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane has a molecular weight of 407.11 g/mol, XLogP of 7.78, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane is sourced from PubChem (CID 163422359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).