(7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane

C11H22OSi — CID 10058634

IUPAC(7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
SMILES[2H]C1([2H])C2(C)CCCCC12O[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-10-7-5-6-8-11(10,9-10)12-13(2,3)4/h5-9H2,1-4H3/i9D2
InChIKeySSFJSYSNWCKRDK-KNXIQCGSSA-N
MW200.39 g/mol
LogP3.56
Rot. Bonds2

About (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane

(7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane (PubChem CID 10058634) has the molecular formula C11H22OSi and a molecular weight of 200.39 g/mol. Its IUPAC name is (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane.

Molecular Properties

Compound Name(7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
PubChem CID10058634
Molecular FormulaC11H22OSi
Molecular Weight200.39 g/mol
Exact Mass200.16
IUPAC Name(7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
SMILES[2H]C1([2H])C2(C)CCCCC12O[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-10-7-5-6-8-11(10,9-10)12-13(2,3)4/h5-9H2,1-4H3/i9D2
InChIKeySSFJSYSNWCKRDK-KNXIQCGSSA-N
XLogP3.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.39
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane?
The IUPAC name of (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane (CID 10058634) is (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane.
What is the SMILES notation for (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane?
The canonical SMILES for (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane is [2H]C1([2H])C2(C)CCCCC12O[Si](C)(C)C.
What is the InChIKey of (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane?
The InChIKey is SSFJSYSNWCKRDK-KNXIQCGSSA-N. The full InChI is InChI=1S/C11H22OSi/c1-10-7-5-6-8-11(10,9-10)12-13(2,3)4/h5-9H2,1-4H3/i9D2.
What are the key properties of (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane?
(7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane has a molecular weight of 200.39 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7,7-dideuterio-6-methyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane is sourced from PubChem (CID 10058634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).