trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane

C19H24OSi — CID 15366208

IUPACtrimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane
SMILESC[Si](C)(C)OC1=CC(c2cccc3ccccc23)CCC1
InChIInChI=1S/C19H24OSi/c1-21(2,3)20-17-11-6-10-16(14-17)19-13-7-9-15-8-4-5-12-18(15)19/h4-5,7-9,12-14,16H,6,10-11H2,1-3H3
InChIKeyUMMJWMVDAJGUTA-UHFFFAOYSA-N
MW296.49 g/mol
LogP5.84
Rot. Bonds3

About trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane

trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane (PubChem CID 15366208) has the molecular formula C19H24OSi and a molecular weight of 296.49 g/mol. Its IUPAC name is trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane.

Molecular Properties

Compound Nametrimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane
PubChem CID15366208
Molecular FormulaC19H24OSi
Molecular Weight296.49 g/mol
Exact Mass296.16
IUPAC Nametrimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane
SMILESC[Si](C)(C)OC1=CC(c2cccc3ccccc23)CCC1
InChIInChI=1S/C19H24OSi/c1-21(2,3)20-17-11-6-10-16(14-17)19-13-7-9-15-8-4-5-12-18(15)19/h4-5,7-9,12-14,16H,6,10-11H2,1-3H3
InChIKeyUMMJWMVDAJGUTA-UHFFFAOYSA-N
XLogP5.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.49
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane?
The IUPAC name of trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane (CID 15366208) is trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane.
What is the SMILES notation for trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane?
The canonical SMILES for trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane is C[Si](C)(C)OC1=CC(c2cccc3ccccc23)CCC1.
What is the InChIKey of trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane?
The InChIKey is UMMJWMVDAJGUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24OSi/c1-21(2,3)20-17-11-6-10-16(14-17)19-13-7-9-15-8-4-5-12-18(15)19/h4-5,7-9,12-14,16H,6,10-11H2,1-3H3.
What are the key properties of trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane?
trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane has a molecular weight of 296.49 g/mol, XLogP of 5.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane is sourced from PubChem (CID 15366208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).