tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane

C11H22O2Si — CID 89397580

IUPACtert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane
SMILESCC(C)(C)[Si](C)(C)OC1CC2O[C@@H]2C1
InChIInChI=1S/C11H22O2Si/c1-11(2,3)14(4,5)13-8-6-9-10(7-8)12-9/h8-10H,6-7H2,1-5H3/t8?,9-,10?/m1/s1
InChIKeyQVPBHMLKEBBZOP-HWOCKDDLSA-N
MW214.38 g/mol
LogP2.94
Rot. Bonds2

About tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane

tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane (PubChem CID 89397580) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane
PubChem CID89397580
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Nametert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane
SMILESCC(C)(C)[Si](C)(C)OC1CC2O[C@@H]2C1
InChIInChI=1S/C11H22O2Si/c1-11(2,3)14(4,5)13-8-6-9-10(7-8)12-9/h8-10H,6-7H2,1-5H3/t8?,9-,10?/m1/s1
InChIKeyQVPBHMLKEBBZOP-HWOCKDDLSA-N
XLogP2.94
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane (CID 89397580) is tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane is CC(C)(C)[Si](C)(C)OC1CC2O[C@@H]2C1.
What is the InChIKey of tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane?
The InChIKey is QVPBHMLKEBBZOP-HWOCKDDLSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-11(2,3)14(4,5)13-8-6-9-10(7-8)12-9/h8-10H,6-7H2,1-5H3/t8?,9-,10?/m1/s1.
What are the key properties of tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane?
tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane has a molecular weight of 214.38 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane is sourced from PubChem (CID 89397580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).