2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane

C18H32OSi — CID 20678368

IUPAC2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane
SMILESCC1C(O[Si](C)(C)C(C)(C)C(C)C)CC2C=CC=CC21
InChIInChI=1S/C18H32OSi/c1-13(2)18(4,5)20(6,7)19-17-12-15-10-8-9-11-16(15)14(17)3/h8-11,13-17H,12H2,1-7H3
InChIKeyIIBAAAYFOSJQER-UHFFFAOYSA-N
MW292.54 g/mol
LogP5.41
Rot. Bonds4

About 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane

2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane (PubChem CID 20678368) has the molecular formula C18H32OSi and a molecular weight of 292.54 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane.

Molecular Properties

Compound Name2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane
PubChem CID20678368
Molecular FormulaC18H32OSi
Molecular Weight292.54 g/mol
Exact Mass292.22
IUPAC Name2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane
SMILESCC1C(O[Si](C)(C)C(C)(C)C(C)C)CC2C=CC=CC21
InChIInChI=1S/C18H32OSi/c1-13(2)18(4,5)20(6,7)19-17-12-15-10-8-9-11-16(15)14(17)3/h8-11,13-17H,12H2,1-7H3
InChIKeyIIBAAAYFOSJQER-UHFFFAOYSA-N
XLogP5.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.54
LogP ≤ 55.41
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 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane?
The IUPAC name of 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane (CID 20678368) is 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane.
What is the SMILES notation for 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane?
The canonical SMILES for 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane is CC1C(O[Si](C)(C)C(C)(C)C(C)C)CC2C=CC=CC21.
What is the InChIKey of 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane?
The InChIKey is IIBAAAYFOSJQER-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32OSi/c1-13(2)18(4,5)20(6,7)19-17-12-15-10-8-9-11-16(15)14(17)3/h8-11,13-17H,12H2,1-7H3.
What are the key properties of 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane?
2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane has a molecular weight of 292.54 g/mol, XLogP of 5.41, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-yl-dimethyl-[(1-methyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)oxy]silane is sourced from PubChem (CID 20678368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).