triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane

C17H30OSi — CID 10869629

IUPACtriethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane
SMILESCC[Si](CC)(CC)OC12CCC=C(C)C1=CCCC2
InChIInChI=1S/C17H30OSi/c1-5-19(6-2,7-3)18-17-13-9-8-12-16(17)15(4)11-10-14-17/h11-12H,5-10,13-14H2,1-4H3
InChIKeyVSRVLSCVQNZOKL-UHFFFAOYSA-N
MW278.51 g/mol
LogP5.60
Rot. Bonds5

About triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane

triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane (PubChem CID 10869629) has the molecular formula C17H30OSi and a molecular weight of 278.51 g/mol. Its IUPAC name is triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane.

Molecular Properties

Compound Nametriethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane
PubChem CID10869629
Molecular FormulaC17H30OSi
Molecular Weight278.51 g/mol
Exact Mass278.21
IUPAC Nametriethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane
SMILESCC[Si](CC)(CC)OC12CCC=C(C)C1=CCCC2
InChIInChI=1S/C17H30OSi/c1-5-19(6-2,7-3)18-17-13-9-8-12-16(17)15(4)11-10-14-17/h11-12H,5-10,13-14H2,1-4H3
InChIKeyVSRVLSCVQNZOKL-UHFFFAOYSA-N
XLogP5.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.51
LogP ≤ 55.60
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 triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane?
The IUPAC name of triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane (CID 10869629) is triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane.
What is the SMILES notation for triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane?
The canonical SMILES for triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane is CC[Si](CC)(CC)OC12CCC=C(C)C1=CCCC2.
What is the InChIKey of triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane?
The InChIKey is VSRVLSCVQNZOKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30OSi/c1-5-19(6-2,7-3)18-17-13-9-8-12-16(17)15(4)11-10-14-17/h11-12H,5-10,13-14H2,1-4H3.
What are the key properties of triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane?
triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane has a molecular weight of 278.51 g/mol, XLogP of 5.60, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(8-methyl-3,4,5,6-tetrahydro-2H-naphthalen-4a-yl)oxy]silane is sourced from PubChem (CID 10869629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).