tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane

C16H32OSi — CID 14446389

IUPACtert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane
SMILESCC1(C)C2CCC1(C)C(O[Si](C)(C)C(C)(C)C)C2
InChIInChI=1S/C16H32OSi/c1-14(2,3)18(7,8)17-13-11-12-9-10-16(13,6)15(12,4)5/h12-13H,9-11H2,1-8H3
InChIKeyZORATVMHRPDTCQ-UHFFFAOYSA-N
MW268.52 g/mol
LogP5.22
Rot. Bonds2

About tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane

tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane (PubChem CID 14446389) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane
PubChem CID14446389
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Nametert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane
SMILESCC1(C)C2CCC1(C)C(O[Si](C)(C)C(C)(C)C)C2
InChIInChI=1S/C16H32OSi/c1-14(2,3)18(7,8)17-13-11-12-9-10-16(13,6)15(12,4)5/h12-13H,9-11H2,1-8H3
InChIKeyZORATVMHRPDTCQ-UHFFFAOYSA-N
XLogP5.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.22
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-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane (CID 14446389) is tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane is CC1(C)C2CCC1(C)C(O[Si](C)(C)C(C)(C)C)C2.
What is the InChIKey of tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane?
The InChIKey is ZORATVMHRPDTCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-14(2,3)18(7,8)17-13-11-12-9-10-16(13,6)15(12,4)5/h12-13H,9-11H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane?
tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane has a molecular weight of 268.52 g/mol, XLogP of 5.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]silane is sourced from PubChem (CID 14446389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).