tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane

C22H40O3Si — CID 10738587

IUPACtert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane
SMILESC/C(=C/CO[Si](C)(C)C(C)(C)C)C(C)CCC1=CCCCC12OCCO2
InChIInChI=1S/C22H40O3Si/c1-18(19(2)13-15-25-26(6,7)21(3,4)5)11-12-20-10-8-9-14-22(20)23-16-17-24-22/h10,13,18H,8-9,11-12,14-17H2,1-7H3/b19-13-
InChIKeyGKUGLLCILCDNDV-UYRXBGFRSA-N
MW380.65 g/mol
LogP6.22
Rot. Bonds7

About tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane

tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane (PubChem CID 10738587) has the molecular formula C22H40O3Si and a molecular weight of 380.65 g/mol. Its IUPAC name is tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane
PubChem CID10738587
Molecular FormulaC22H40O3Si
Molecular Weight380.65 g/mol
Exact Mass380.27
IUPAC Nametert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane
SMILESC/C(=C/CO[Si](C)(C)C(C)(C)C)C(C)CCC1=CCCCC12OCCO2
InChIInChI=1S/C22H40O3Si/c1-18(19(2)13-15-25-26(6,7)21(3,4)5)11-12-20-10-8-9-14-22(20)23-16-17-24-22/h10,13,18H,8-9,11-12,14-17H2,1-7H3/b19-13-
InChIKeyGKUGLLCILCDNDV-UYRXBGFRSA-N
XLogP6.22
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.65
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl-[(Z,2R)-7-(1,3-dioxolan-2-yl)-4-iodo-1-[(1R)-4-methyl-7-methylidenecyclohept-3-en-1-yl]hept-3-en-2-yl]oxy-dimethylsilane
CID 11027994
2-methyl-2-[(4R)-4-methylcyclohexen-1-yl]-1,3-dioxolane
CID 139467954
tert-butyl-[(Z,2S)-7-(1,3-dioxolan-2-yl)-4-iodo-1-[(1R)-4-methyl-7-methylidenecyclohept-3-en-1-yl]hept-3-en-2-yl]oxy-dimethylsilane
CID 10929649
[(3R,5R)-3-[2-(1,3-dioxolan-2-yl)ethyl]-5-methyl-2-prop-2-enylcyclohexen-1-yl]oxy-trimethylsilane
CID 45113084
Trimethyl-[4-methyl-3-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexen-1-yl]oxysilane
CID 74955942
tert-butyl-[2-[(1S,5S)-2-[[(2S,6S)-2-(methoxymethoxymethyl)-5-methyl-3,6-dihydro-2H-pyran-6-yl]methyl]-1-methyl-5-propan-2-ylcyclopent-2-en-1-yl]ethoxy]-dimethylsilane
CID 101234070
tert-butyl-[2-[(1S,5S)-2-[[(2S,6R)-2-(methoxymethoxymethyl)-5-methyl-3,6-dihydro-2H-pyran-6-yl]methyl]-1-methyl-5-propan-2-ylcyclopent-2-en-1-yl]ethoxy]-dimethylsilane
CID 134930786
[(3R)-3-[(E)-3-butoxyprop-1-enyl]-2-butylcyclohexen-1-yl]oxy-triethylsilane
CID 176427857
[(3R)-3-[3-[(E)-but-2-enoxy]prop-1-en-2-yl]-2-butylcyclohexen-1-yl]oxy-triethylsilane
CID 176427868
[(3R)-3-[(E)-3-[(E)-but-2-enoxy]prop-1-enyl]-2-butylcyclohexen-1-yl]oxy-triethylsilane
CID 176427869
[(3R)-2-butyl-3-[(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclohexen-1-yl]oxy-triethylsilane
CID 176427871
Tert-butyl-[4-(1,4-dioxaspiro[4.4]non-8-en-7-yl)butoxy]-dimethylsilane
CID 10892351

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane (CID 10738587) is tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane is C/C(=C/CO[Si](C)(C)C(C)(C)C)C(C)CCC1=CCCCC12OCCO2.
What is the InChIKey of tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane?
The InChIKey is GKUGLLCILCDNDV-UYRXBGFRSA-N. The full InChI is InChI=1S/C22H40O3Si/c1-18(19(2)13-15-25-26(6,7)21(3,4)5)11-12-20-10-8-9-14-22(20)23-16-17-24-22/h10,13,18H,8-9,11-12,14-17H2,1-7H3/b19-13-.
What are the key properties of tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane?
tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane has a molecular weight of 380.65 g/mol, XLogP of 6.22, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(Z)-6-(1,4-dioxaspiro[4.5]dec-6-en-6-yl)-3,4-dimethylhex-2-enoxy]-dimethylsilane is sourced from PubChem (CID 10738587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).