trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane

C23H46O2Si2 — CID 58601700

IUPACtrimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane
SMILESC/C(=C\CO[Si](C(C)C)(C(C)C)C(C)C)C1C=C(O[Si](C)(C)C)C[C@H](C)C1
InChIInChI=1S/C23H46O2Si2/c1-17(2)27(18(3)4,19(5)6)24-13-12-21(8)22-14-20(7)15-23(16-22)25-26(9,10)11/h12,16-20,22H,13-15H2,1-11H3/b21-12+/t20-,22?/m1/s1
InChIKeyKSRCNQPIFNWMNA-WEBDBCONSA-N
MW410.79 g/mol
LogP7.91
Rot. Bonds9

About trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane

trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane (PubChem CID 58601700) has the molecular formula C23H46O2Si2 and a molecular weight of 410.79 g/mol. Its IUPAC name is trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane
PubChem CID58601700
Molecular FormulaC23H46O2Si2
Molecular Weight410.79 g/mol
Exact Mass410.30
IUPAC Nametrimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane
SMILESC/C(=C\CO[Si](C(C)C)(C(C)C)C(C)C)C1C=C(O[Si](C)(C)C)C[C@H](C)C1
InChIInChI=1S/C23H46O2Si2/c1-17(2)27(18(3)4,19(5)6)24-13-12-21(8)22-14-20(7)15-23(16-22)25-26(9,10)11/h12,16-20,22H,13-15H2,1-11H3/b21-12+/t20-,22?/m1/s1
InChIKeyKSRCNQPIFNWMNA-WEBDBCONSA-N
XLogP7.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.79
LogP ≤ 57.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

[(4aS,5S)-5-[tert-butyl(dimethyl)silyl]oxy-2,3,4,4a,5,8-hexahydro-1H-benzo[7]annulen-9-yl]oxy-tert-butyl-dimethylsilane
CID 11090852
[(3S,5R)-3-buta-2,3-dien-2-yl-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]oxy-tert-butyl-dimethylsilane
CID 11244074
trimethyl-[(3R,5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane
CID 11774244
Tert-butyl-[(3-decylcyclopenten-1-yl)methoxy]-dimethylsilane
CID 101011318
Tert-butyl-[[6-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-2-en-1-yl]cyclohexen-1-yl]methoxy]-dimethylsilane
CID 102475884
Tert-butyl-[(6-ethenylcyclohexen-1-yl)methoxy]-dimethylsilane
CID 102475885
Tert-butyl-[[6-(1-ethoxyethenyl)cyclohexen-1-yl]methoxy]-dimethylsilane
CID 102475886
[(E,1S)-1-cyclohexyl-2-ethylpent-2-enoxy]-triethylsilane
CID 102515909
[(E,1S)-1-cyclohexylnon-2-enoxy]-triethylsilane
CID 102515912
[(3R,4R)-3-but-3-enyl-4-[tert-butyl(dimethyl)silyl]oxycyclohexen-1-yl]oxy-trimethylsilane
CID 134837952
lithium (Z,1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-cyclohexylbut-2-en-2-olate
CID 134846364
Tert-butyl-(4-decyl-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane
CID 134905111

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane?
The IUPAC name of trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane (CID 58601700) is trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane.
What is the SMILES notation for trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane?
The canonical SMILES for trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane is C/C(=C\CO[Si](C(C)C)(C(C)C)C(C)C)C1C=C(O[Si](C)(C)C)C[C@H](C)C1.
What is the InChIKey of trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane?
The InChIKey is KSRCNQPIFNWMNA-WEBDBCONSA-N. The full InChI is InChI=1S/C23H46O2Si2/c1-17(2)27(18(3)4,19(5)6)24-13-12-21(8)22-14-20(7)15-23(16-22)25-26(9,10)11/h12,16-20,22H,13-15H2,1-11H3/b21-12+/t20-,22?/m1/s1.
What are the key properties of trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane?
trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane has a molecular weight of 410.79 g/mol, XLogP of 7.91, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(5R)-5-methyl-3-[(E)-4-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclohexen-1-yl]oxysilane is sourced from PubChem (CID 58601700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).