[(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane

C12H24OSi — CID 135060358

IUPAC[(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)O[C@@H]1CC[C@H]2C[C@H]21
InChIInChI=1S/C12H24OSi/c1-12(2,3)14(4,5)13-11-7-6-9-8-10(9)11/h9-11H,6-8H2,1-5H3/t9-,10+,11+/m0/s1
InChIKeyBIEFIBVIBKDCSE-HBNTYKKESA-N
MW212.41 g/mol
LogP3.81
Rot. Bonds2

About [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane

[(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane (PubChem CID 135060358) has the molecular formula C12H24OSi and a molecular weight of 212.41 g/mol. Its IUPAC name is [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane
PubChem CID135060358
Molecular FormulaC12H24OSi
Molecular Weight212.41 g/mol
Exact Mass212.16
IUPAC Name[(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)O[C@@H]1CC[C@H]2C[C@H]21
InChIInChI=1S/C12H24OSi/c1-12(2,3)14(4,5)13-11-7-6-9-8-10(9)11/h9-11H,6-8H2,1-5H3/t9-,10+,11+/m0/s1
InChIKeyBIEFIBVIBKDCSE-HBNTYKKESA-N
XLogP3.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.41
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[(1R,2S)-2-methylcyclopentyl]oxysilane
CID 11365831
trimethyl-[(1R,2R)-2-methylcyclopentyl]oxysilane
CID 12670197
1-Bicyclo[3.1.0]hexanyloxy(trimethyl)silane
CID 13183994
lithium tert-butyl-[(1S,2R)-2-methanidylcyclopentyl]oxy-dimethylsilane
CID 134895891
tert-Butyl(dimethyl)[(2-methylcyclopentyl)oxy]silane
CID 12663915
Trimethyl-(2-methylcyclopentyl)oxysilane
CID 12670196
[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane
CID 15319505
Tert-butyl-dimethyl-(3-methylcyclopentyl)oxysilane
CID 59121110
trimethyl-[(1S,2S)-2-methylcyclopentyl]oxysilane
CID 89510158
Triethyl-(2-methylcyclopentyl)oxysilane
CID 101793032
3-Bicyclo[3.1.0]hexanyloxy-tert-butyl-dimethylsilane
CID 129011491
1-Cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane
CID 139996962

Frequently Asked Questions

What is the IUPAC name of [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane?
The IUPAC name of [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane (CID 135060358) is [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane.
What is the SMILES notation for [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane?
The canonical SMILES for [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)O[C@@H]1CC[C@H]2C[C@H]21.
What is the InChIKey of [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane?
The InChIKey is BIEFIBVIBKDCSE-HBNTYKKESA-N. The full InChI is InChI=1S/C12H24OSi/c1-12(2,3)14(4,5)13-11-7-6-9-8-10(9)11/h9-11H,6-8H2,1-5H3/t9-,10+,11+/m0/s1.
What are the key properties of [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane?
[(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane has a molecular weight of 212.41 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R,5S)-2-bicyclo[3.1.0]hexanyl]oxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 135060358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).