dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane

C30H28Si — CID 617108

IUPACdimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane
SMILESCC1=Cc2c(ccc3ccccc23)C1[Si](C)(C)C1C(C)=Cc2c1ccc1ccccc21
InChIInChI=1S/C30H28Si/c1-19-17-27-23-11-7-5-9-21(23)13-15-25(27)29(19)31(3,4)30-20(2)18-28-24-12-8-6-10-22(24)14-16-26(28)30/h5-18,29-30H,1-4H3
InChIKeyBFYCOQTXODFUOQ-UHFFFAOYSA-N
MW416.64 g/mol
LogP8.48
Rot. Bonds2

About dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane

dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane (PubChem CID 617108) has the molecular formula C30H28Si and a molecular weight of 416.64 g/mol. Its IUPAC name is dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane.

Molecular Properties

Compound Namedimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane
PubChem CID617108
Molecular FormulaC30H28Si
Molecular Weight416.64 g/mol
Exact Mass416.20
IUPAC Namedimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane
SMILESCC1=Cc2c(ccc3ccccc23)C1[Si](C)(C)C1C(C)=Cc2c1ccc1ccccc21
InChIInChI=1S/C30H28Si/c1-19-17-27-23-11-7-5-9-21(23)13-15-25(27)29(19)31(3,4)30-20(2)18-28-24-12-8-6-10-22(24)14-16-26(28)30/h5-18,29-30H,1-4H3
InChIKeyBFYCOQTXODFUOQ-UHFFFAOYSA-N
XLogP8.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.64
LogP ≤ 58.48
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

N-[dimethyl-(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silyl]-2-methylpropan-2-amine
CID 135046771
dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane
CID 161108029
dimethyl-bis[(1R)-2-methyl-4-phenyl-1H-inden-1-yl]silane
CID 101111754
chloro-[dimethyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane
CID 163422359
CID 142750810
CID 142750810
chloro-methyl-(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)-phenylsilane
CID 57186607
bis(2-chloro-4-naphthalen-1-yl-1H-inden-1-yl)-dimethylsilane
CID 141041116
bis[(3R)-3H-cyclopenta[a]naphthalen-3-yl]-dimethylsilane
CID 101485885
bis[(3S)-3H-cyclopenta[a]naphthalen-3-yl]-dimethylsilane
CID 101485886
dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane
CID 68772600
(4-cyclohexyl-2-methyl-1H-inden-1-yl)-dimethyl-(2-methyl-1H-inden-1-yl)silane
CID 67039854
[1-[(4-bromo-2-methyl-1H-inden-1-yl)-dimethylsilyl]-2-methyl-1H-inden-4-yl]-diphenylphosphane
CID 87245680

Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane?
The IUPAC name of dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane (CID 617108) is dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane.
What is the SMILES notation for dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane?
The canonical SMILES for dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane is CC1=Cc2c(ccc3ccccc23)C1[Si](C)(C)C1C(C)=Cc2c1ccc1ccccc21.
What is the InChIKey of dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane?
The InChIKey is BFYCOQTXODFUOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28Si/c1-19-17-27-23-11-7-5-9-21(23)13-15-25(27)29(19)31(3,4)30-20(2)18-28-24-12-8-6-10-22(24)14-16-26(28)30/h5-18,29-30H,1-4H3.
What are the key properties of dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane?
dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane has a molecular weight of 416.64 g/mol, XLogP of 8.48, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(2-methyl-3H-cyclopenta[a]naphthalen-3-yl)silane is sourced from PubChem (CID 617108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).