tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane

C17H36O2Si2 — CID 11056563

IUPACtert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane
SMILESC[C@@H]1C=C(O[Si](C)(C)C)C[C@H](C)[C@@H]1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H36O2Si2/c1-13-11-15(18-20(6,7)8)12-14(2)16(13)19-21(9,10)17(3,4)5/h11,13-14,16H,12H2,1-10H3/t13-,14+,16-/m1/s1
InChIKeyULGUVMWYWWUGLP-IJEWVQPXSA-N
MW328.65 g/mol
LogP5.79
Rot. Bonds4

About tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane

tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane (PubChem CID 11056563) has the molecular formula C17H36O2Si2 and a molecular weight of 328.65 g/mol. Its IUPAC name is tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane
PubChem CID11056563
Molecular FormulaC17H36O2Si2
Molecular Weight328.65 g/mol
Exact Mass328.23
IUPAC Nametert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane
SMILESC[C@@H]1C=C(O[Si](C)(C)C)C[C@H](C)[C@@H]1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H36O2Si2/c1-13-11-15(18-20(6,7)8)12-14(2)16(13)19-21(9,10)17(3,4)5/h11,13-14,16H,12H2,1-10H3/t13-,14+,16-/m1/s1
InChIKeyULGUVMWYWWUGLP-IJEWVQPXSA-N
XLogP5.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.65
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane with MolForge

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Related Compounds

Tert-butyl-dimethyl-(4-trimethylsilyloxycyclohex-3-en-1-yl)oxysilane
CID 85257334
tert-butyl-dimethyl-[(1S)-4-trimethylsilyloxycyclohex-3-en-1-yl]oxysilane
CID 10756665
trimethyl-[(3R,5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane
CID 11774244
tert-butyl-[(1S,2S)-2-ethenyl-2-methyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane
CID 14951420
[(3R,4R)-3-but-3-enyl-4-[tert-butyl(dimethyl)silyl]oxycyclohexen-1-yl]oxy-trimethylsilane
CID 134837952
tert-butyl-dimethyl-[[(1S,5R)-3-trimethylsilyloxy-6-bicyclo[3.1.0]hex-2-enyl]methoxy]silane
CID 134906272
tert-butyl-dimethyl-[(1R)-4-trimethylsilyloxycyclohex-3-en-1-yl]oxysilane
CID 134976038
Tert-butyl-dimethyl-[2-(2-trimethylsilyloxycyclohex-2-en-1-yl)ethoxy]silane
CID 19379284
Tert-butyl-dimethyl-[(2-trimethylsilyloxycyclohex-2-en-1-yl)methoxy]silane
CID 19379293
Tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-methylcyclopent-3-en-1-yl]methoxy]-dimethylsilane
CID 54533592
tert-butyl-[[(1R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-3-en-1-yl]methoxy]-dimethylsilane
CID 57165253
trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane
CID 58601700

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane (CID 11056563) is tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane is C[C@@H]1C=C(O[Si](C)(C)C)C[C@H](C)[C@@H]1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane?
The InChIKey is ULGUVMWYWWUGLP-IJEWVQPXSA-N. The full InChI is InChI=1S/C17H36O2Si2/c1-13-11-15(18-20(6,7)8)12-14(2)16(13)19-21(9,10)17(3,4)5/h11,13-14,16H,12H2,1-10H3/t13-,14+,16-/m1/s1.
What are the key properties of tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane?
tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane has a molecular weight of 328.65 g/mol, XLogP of 5.79, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(1S,2R,6S)-2,6-dimethyl-4-trimethylsilyloxycyclohex-3-en-1-yl]oxy-dimethylsilane is sourced from PubChem (CID 11056563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).