trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane

C11H22OSi — CID 11769486

IUPACtrimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane
SMILESC[C@H]1CCC[C@]2(O[Si](C)(C)C)C[C@H]12
InChIInChI=1S/C11H22OSi/c1-9-6-5-7-11(8-10(9)11)12-13(2,3)4/h9-10H,5-8H2,1-4H3/t9-,10+,11-/m0/s1
InChIKeyNAKOGCHBTBWOTP-AXFHLTTASA-N
MW198.38 g/mol
LogP3.42
Rot. Bonds2

About trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane

trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane (PubChem CID 11769486) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane.

Molecular Properties

Compound Nametrimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane
PubChem CID11769486
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Nametrimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane
SMILESC[C@H]1CCC[C@]2(O[Si](C)(C)C)C[C@H]12
InChIInChI=1S/C11H22OSi/c1-9-6-5-7-11(8-10(9)11)12-13(2,3)4/h9-10H,5-8H2,1-4H3/t9-,10+,11-/m0/s1
InChIKeyNAKOGCHBTBWOTP-AXFHLTTASA-N
XLogP3.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.42
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

1-Trimethylsiloxybicyclo[4.1.0]heptane
CID 11063094
Trimethyl-[(6-methyl-1-bicyclo[4.1.0]heptanyl)oxy]silane
CID 13183995
trimethyl-[[(1R,6R)-6-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane
CID 50993556
[(1R,6R)-1-bicyclo[4.1.0]heptanyl]oxy-trimethylsilane
CID 129403949
trimethyl-[[(1R,6S,7S)-7-propan-2-yl-1-bicyclo[4.1.0]heptanyl]oxy]silane
CID 135015623
(2,6-Dimethyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
CID 135037711
[(1R,2R,5S,6R)-5-ethyl-2-bicyclo[4.1.0]heptanyl]oxy-trimethylsilane
CID 139263687
Tert-butyl-[(4,6-dimethyl-1-bicyclo[4.1.0]heptanyl)oxy]-dimethylsilane
CID 140723747
5-Ethyl-1-methoxybicyclo[4.1.0]heptane
CID 163844778
(6-Butyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
CID 10037316
(7,7-Dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
CID 10058634
(6-Ethyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
CID 10104629

Frequently Asked Questions

What is the IUPAC name of trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane?
The IUPAC name of trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane (CID 11769486) is trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane.
What is the SMILES notation for trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane?
The canonical SMILES for trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane is C[C@H]1CCC[C@]2(O[Si](C)(C)C)C[C@H]12.
What is the InChIKey of trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane?
The InChIKey is NAKOGCHBTBWOTP-AXFHLTTASA-N. The full InChI is InChI=1S/C11H22OSi/c1-9-6-5-7-11(8-10(9)11)12-13(2,3)4/h9-10H,5-8H2,1-4H3/t9-,10+,11-/m0/s1.
What are the key properties of trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane?
trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane has a molecular weight of 198.38 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[(1S,5S,6R)-5-methyl-1-bicyclo[4.1.0]heptanyl]oxy]silane is sourced from PubChem (CID 11769486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).