trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane

C12H22O2Si — CID 10398808

IUPACtrimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane
SMILESC[Si](C)(C)O/C1=C/CCCCCC12CO2
InChIInChI=1S/C12H22O2Si/c1-15(2,3)14-11-8-6-4-5-7-9-12(11)10-13-12/h8H,4-7,9-10H2,1-3H3/b11-8+
InChIKeyVNNLBSAFMMLPKB-DHZHZOJOSA-N
MW226.39 g/mol
LogP3.45
Rot. Bonds2

About trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane

trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane (PubChem CID 10398808) has the molecular formula C12H22O2Si and a molecular weight of 226.39 g/mol. Its IUPAC name is trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane.

Molecular Properties

Compound Nametrimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane
PubChem CID10398808
Molecular FormulaC12H22O2Si
Molecular Weight226.39 g/mol
Exact Mass226.14
IUPAC Nametrimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane
SMILESC[Si](C)(C)O/C1=C/CCCCCC12CO2
InChIInChI=1S/C12H22O2Si/c1-15(2,3)14-11-8-6-4-5-7-9-12(11)10-13-12/h8H,4-7,9-10H2,1-3H3/b11-8+
InChIKeyVNNLBSAFMMLPKB-DHZHZOJOSA-N
XLogP3.45
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.39
LogP ≤ 53.45
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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Related Compounds

Trimethyl-[(1-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane
CID 12771792
(2,2-Dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy-trimethylsilane
CID 10013942
Tert-butyl-dimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane
CID 10015202
Tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane
CID 10037969
Trimethyl(1-oxaspiro[2.6]non-4-en-4-yloxy)silane
CID 10059049
trimethyl(spiro[4a,5,6,7,8,8a-hexahydro-4H-naphthalene-3,2'-oxirane]-2-yloxy)silane
CID 10060794
tert-butyl-dimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane
CID 10265045
Trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane
CID 10398284
Tert-butyl-[(6-butyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]-dimethylsilane
CID 11055137

Frequently Asked Questions

What is the IUPAC name of trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane?
The IUPAC name of trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane (CID 10398808) is trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane.
What is the SMILES notation for trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane?
The canonical SMILES for trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane is C[Si](C)(C)O/C1=C/CCCCCC12CO2.
What is the InChIKey of trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane?
The InChIKey is VNNLBSAFMMLPKB-DHZHZOJOSA-N. The full InChI is InChI=1S/C12H22O2Si/c1-15(2,3)14-11-8-6-4-5-7-9-12(11)10-13-12/h8H,4-7,9-10H2,1-3H3/b11-8+.
What are the key properties of trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane?
trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane has a molecular weight of 226.39 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane is sourced from PubChem (CID 10398808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).