trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane

C11H20O2Si — CID 10398284

IUPACtrimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane
SMILESCC1OC12CCCC=C2O[Si](C)(C)C
InChIInChI=1S/C11H20O2Si/c1-9-11(12-9)8-6-5-7-10(11)13-14(2,3)4/h7,9H,5-6,8H2,1-4H3
InChIKeyHSRVRUVCHAXZKJ-UHFFFAOYSA-N
MW212.36 g/mol
LogP3.06
Rot. Bonds2

About trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane

trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane (PubChem CID 10398284) has the molecular formula C11H20O2Si and a molecular weight of 212.36 g/mol. Its IUPAC name is trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane.

Molecular Properties

Compound Nametrimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane
PubChem CID10398284
Molecular FormulaC11H20O2Si
Molecular Weight212.36 g/mol
Exact Mass212.12
IUPAC Nametrimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane
SMILESCC1OC12CCCC=C2O[Si](C)(C)C
InChIInChI=1S/C11H20O2Si/c1-9-11(12-9)8-6-5-7-10(11)13-14(2,3)4/h7,9H,5-6,8H2,1-4H3
InChIKeyHSRVRUVCHAXZKJ-UHFFFAOYSA-N
XLogP3.06
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane?
The IUPAC name of trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane (CID 10398284) is trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane.
What is the SMILES notation for trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane?
The canonical SMILES for trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane is CC1OC12CCCC=C2O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane?
The InChIKey is HSRVRUVCHAXZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2Si/c1-9-11(12-9)8-6-5-7-10(11)13-14(2,3)4/h7,9H,5-6,8H2,1-4H3.
What are the key properties of trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane?
trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane has a molecular weight of 212.36 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane is sourced from PubChem (CID 10398284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).