triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane

C16H28OSi — CID 11086661

IUPACtriethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane
SMILESCC[Si](CC)(CC)OC12CCC=C(C)C1=CCC2
InChIInChI=1S/C16H28OSi/c1-5-18(6-2,7-3)17-16-12-8-10-14(4)15(16)11-9-13-16/h10-11H,5-9,12-13H2,1-4H3
InChIKeyWOCJTAIJKNDEKH-UHFFFAOYSA-N
MW264.48 g/mol
LogP5.21
Rot. Bonds5

About triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane

triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane (PubChem CID 11086661) has the molecular formula C16H28OSi and a molecular weight of 264.48 g/mol. Its IUPAC name is triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane.

Molecular Properties

Compound Nametriethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane
PubChem CID11086661
Molecular FormulaC16H28OSi
Molecular Weight264.48 g/mol
Exact Mass264.19
IUPAC Nametriethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane
SMILESCC[Si](CC)(CC)OC12CCC=C(C)C1=CCC2
InChIInChI=1S/C16H28OSi/c1-5-18(6-2,7-3)17-16-12-8-10-14(4)15(16)11-9-13-16/h10-11H,5-9,12-13H2,1-4H3
InChIKeyWOCJTAIJKNDEKH-UHFFFAOYSA-N
XLogP5.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.48
LogP ≤ 55.21
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-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane?
The IUPAC name of triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane (CID 11086661) is triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane.
What is the SMILES notation for triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane?
The canonical SMILES for triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane is CC[Si](CC)(CC)OC12CCC=C(C)C1=CCC2.
What is the InChIKey of triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane?
The InChIKey is WOCJTAIJKNDEKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28OSi/c1-5-18(6-2,7-3)17-16-12-8-10-14(4)15(16)11-9-13-16/h10-11H,5-9,12-13H2,1-4H3.
What are the key properties of triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane?
triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane has a molecular weight of 264.48 g/mol, XLogP of 5.21, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(7-methyl-2,3,4,5-tetrahydroinden-3a-yl)oxy]silane is sourced from PubChem (CID 11086661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).