[(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane

C15H32O2S3Si — CID 173244269

IUPAC[(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane
SMILESCO[SiH](OC)S(C)(CC(C)(C)C)SSC12CCC(CC1)C2
InChIInChI=1S/C15H32O2S3Si/c1-14(2,3)12-20(6,21(16-4)17-5)19-18-15-9-7-13(11-15)8-10-15/h13,21H,7-12H2,1-6H3
InChIKeyIVEKYDFLIDVTGL-UHFFFAOYSA-N
MW368.71 g/mol
LogP5.11
Rot. Bonds7

About [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane

[(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane (PubChem CID 173244269) has the molecular formula C15H32O2S3Si and a molecular weight of 368.71 g/mol. Its IUPAC name is [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane.

Molecular Properties

Compound Name[(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane
PubChem CID173244269
Molecular FormulaC15H32O2S3Si
Molecular Weight368.71 g/mol
Exact Mass368.13
IUPAC Name[(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane
SMILESCO[SiH](OC)S(C)(CC(C)(C)C)SSC12CCC(CC1)C2
InChIInChI=1S/C15H32O2S3Si/c1-14(2,3)12-20(6,21(16-4)17-5)19-18-15-9-7-13(11-15)8-10-15/h13,21H,7-12H2,1-6H3
InChIKeyIVEKYDFLIDVTGL-UHFFFAOYSA-N
XLogP5.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.71
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane with MolForge

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Related Compounds

[2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane
CID 123425987
1-bicyclo[2.2.1]heptanyl-dimethoxy-(2-methylpropyl)silane
CID 23439192
ethane;1-ethylbicyclo[2.2.1]heptane
CID 168937878
1-bicyclo[2.2.1]heptanyl-tri(propan-2-yloxy)silane
CID 22673196
cyclopentyl 2,2-dimethylpropane-1-sulfonate
CID 174663479
1-(2-methylpentan-2-yl)bicyclo[2.2.1]heptane
CID 123762100
8-(1-bicyclo[2.2.1]heptanyl)octyl methanesulfonate
CID 87409729
1-(3-nitrobutan-2-yl)bicyclo[2.2.1]heptane
CID 70236838
(1R)-1-(1-bicyclo[2.2.1]heptanyl)-2-methylpropan-1-ol
CID 134410192
N-[[4-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexyl]methyl]propan-2-amine
CID 62108572
7-(1-bicyclo[2.2.1]heptanyl)-3-methoxyhept-5-enal
CID 174415308
1-(3,3-dimethylbutyl)bicyclo[1.1.1]pentane
CID 163628127

Frequently Asked Questions

What is the IUPAC name of [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane?
The IUPAC name of [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane (CID 173244269) is [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane.
What is the SMILES notation for [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane?
The canonical SMILES for [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane is CO[SiH](OC)S(C)(CC(C)(C)C)SSC12CCC(CC1)C2.
What is the InChIKey of [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane?
The InChIKey is IVEKYDFLIDVTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2S3Si/c1-14(2,3)12-20(6,21(16-4)17-5)19-18-15-9-7-13(11-15)8-10-15/h13,21H,7-12H2,1-6H3.
What are the key properties of [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane?
[(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane has a molecular weight of 368.71 g/mol, XLogP of 5.11, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-bicyclo[2.2.1]heptanyldisulfanyl)-(2,2-dimethylpropyl)-methyl-λ4-sulfanyl]-dimethoxysilane is sourced from PubChem (CID 173244269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).