tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane

C16H30OSi — CID 20704226

IUPACtert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane
SMILESCC1=C(O[Si](C)(C)C(C)(C)C)CC2CCCCC12
InChIInChI=1S/C16H30OSi/c1-12-14-10-8-7-9-13(14)11-15(12)17-18(5,6)16(2,3)4/h13-14H,7-11H2,1-6H3
InChIKeyHLPBSKQBCUFIHP-UHFFFAOYSA-N
MW266.50 g/mol
LogP5.49
Rot. Bonds2

About tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane

tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane (PubChem CID 20704226) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane
PubChem CID20704226
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Nametert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane
SMILESCC1=C(O[Si](C)(C)C(C)(C)C)CC2CCCCC12
InChIInChI=1S/C16H30OSi/c1-12-14-10-8-7-9-13(14)11-15(12)17-18(5,6)16(2,3)4/h13-14H,7-11H2,1-6H3
InChIKeyHLPBSKQBCUFIHP-UHFFFAOYSA-N
XLogP5.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.50
LogP ≤ 55.49
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 tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane (CID 20704226) is tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane is CC1=C(O[Si](C)(C)C(C)(C)C)CC2CCCCC12.
What is the InChIKey of tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane?
The InChIKey is HLPBSKQBCUFIHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30OSi/c1-12-14-10-8-7-9-13(14)11-15(12)17-18(5,6)16(2,3)4/h13-14H,7-11H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane?
tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane has a molecular weight of 266.50 g/mol, XLogP of 5.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3-methyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl)oxy]silane is sourced from PubChem (CID 20704226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).