[(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane

C16H32OSi — CID 173293934

IUPAC[(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane
SMILESCC1=C(C)C(C)(C)C[C@](O[SiH](C)C)(C(C)(C)C)C1
InChIInChI=1S/C16H32OSi/c1-12-10-16(14(3,4)5,17-18(8)9)11-15(6,7)13(12)2/h18H,10-11H2,1-9H3/t16-/m0/s1
InChIKeyRLNRBDOQTAZWOC-INIZCTEOSA-N
MW268.52 g/mol
LogP4.93
Rot. Bonds2

About [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane

[(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane (PubChem CID 173293934) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane.

Molecular Properties

Compound Name[(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane
PubChem CID173293934
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Name[(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane
SMILESCC1=C(C)C(C)(C)C[C@](O[SiH](C)C)(C(C)(C)C)C1
InChIInChI=1S/C16H32OSi/c1-12-10-16(14(3,4)5,17-18(8)9)11-15(6,7)13(12)2/h18H,10-11H2,1-9H3/t16-/m0/s1
InChIKeyRLNRBDOQTAZWOC-INIZCTEOSA-N
XLogP4.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.52
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane?
The IUPAC name of [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane (CID 173293934) is [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane.
What is the SMILES notation for [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane?
The canonical SMILES for [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane is CC1=C(C)C(C)(C)C[C@](O[SiH](C)C)(C(C)(C)C)C1.
What is the InChIKey of [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane?
The InChIKey is RLNRBDOQTAZWOC-INIZCTEOSA-N. The full InChI is InChI=1S/C16H32OSi/c1-12-10-16(14(3,4)5,17-18(8)9)11-15(6,7)13(12)2/h18H,10-11H2,1-9H3/t16-/m0/s1.
What are the key properties of [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane?
[(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane has a molecular weight of 268.52 g/mol, XLogP of 4.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S)-1-tert-butyl-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxy-dimethylsilane is sourced from PubChem (CID 173293934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).