dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane

C17H22Si — CID 14490056

IUPACdimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane
SMILESC=CC(C)(C)[Si](C)(C)c1cccc2ccccc12
InChIInChI=1S/C17H22Si/c1-6-17(2,3)18(4,5)16-13-9-11-14-10-7-8-12-15(14)16/h6-13H,1H2,2-5H3
InChIKeySAZSLGGCHWKMIQ-UHFFFAOYSA-N
MW254.45 g/mol
LogP4.72
Rot. Bonds3

About dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane

dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane (PubChem CID 14490056) has the molecular formula C17H22Si and a molecular weight of 254.45 g/mol. Its IUPAC name is dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane.

Molecular Properties

Compound Namedimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane
PubChem CID14490056
Molecular FormulaC17H22Si
Molecular Weight254.45 g/mol
Exact Mass254.15
IUPAC Namedimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane
SMILESC=CC(C)(C)[Si](C)(C)c1cccc2ccccc12
InChIInChI=1S/C17H22Si/c1-6-17(2,3)18(4,5)16-13-9-11-14-10-7-8-12-15(14)16/h6-13H,1H2,2-5H3
InChIKeySAZSLGGCHWKMIQ-UHFFFAOYSA-N
XLogP4.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.45
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane?
The IUPAC name of dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane (CID 14490056) is dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane.
What is the SMILES notation for dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane?
The canonical SMILES for dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane is C=CC(C)(C)[Si](C)(C)c1cccc2ccccc12.
What is the InChIKey of dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane?
The InChIKey is SAZSLGGCHWKMIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22Si/c1-6-17(2,3)18(4,5)16-13-9-11-14-10-7-8-12-15(14)16/h6-13H,1H2,2-5H3.
What are the key properties of dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane?
dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane has a molecular weight of 254.45 g/mol, XLogP of 4.72, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(2-methylbut-3-en-2-yl)-naphthalen-1-ylsilane is sourced from PubChem (CID 14490056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).