ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane

C28H70S4Si4 — CID 157384422

IUPACethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane
SMILESC.C=C.C[Si](C)(C)CCCCCCC[Si](C)(C)C.C[Si](C)(C)CCCSSSSCCC[Si](C)(C)C
InChIInChI=1S/C13H32Si2.C12H30S4Si2.C2H4.CH4/c1-14(2,3)12-10-8-7-9-11-13-15(4,5)6;1-17(2,3)11-7-9-13-15-16-14-10-8-12-18(4,5)6;1-2;/h7-13H2,1-6H3;7-12H2,1-6H3;1-2H2;1H4
InChIKeyBLGLNZYBMITGLO-UHFFFAOYSA-N
MW647.48 g/mol
LogP14.17
Rot. Bonds19

About ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane

ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane (PubChem CID 157384422) has the molecular formula C28H70S4Si4 and a molecular weight of 647.48 g/mol. Its IUPAC name is ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane.

Molecular Properties

Compound Nameethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane
PubChem CID157384422
Molecular FormulaC28H70S4Si4
Molecular Weight647.48 g/mol
Exact Mass646.34
IUPAC Nameethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane
SMILESC.C=C.C[Si](C)(C)CCCCCCC[Si](C)(C)C.C[Si](C)(C)CCCSSSSCCC[Si](C)(C)C
InChIInChI=1S/C13H32Si2.C12H30S4Si2.C2H4.CH4/c1-14(2,3)12-10-8-7-9-11-13-15(4,5)6;1-17(2,3)11-7-9-13-15-16-14-10-8-12-18(4,5)6;1-2;/h7-13H2,1-6H3;7-12H2,1-6H3;1-2H2;1H4
InChIKeyBLGLNZYBMITGLO-UHFFFAOYSA-N
XLogP14.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds19
Heavy Atoms36
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500647.48
LogP ≤ 514.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane?
The IUPAC name of ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane (CID 157384422) is ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane.
What is the SMILES notation for ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane?
The canonical SMILES for ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane is C.C=C.C[Si](C)(C)CCCCCCC[Si](C)(C)C.C[Si](C)(C)CCCSSSSCCC[Si](C)(C)C.
What is the InChIKey of ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane?
The InChIKey is BLGLNZYBMITGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H32Si2.C12H30S4Si2.C2H4.CH4/c1-14(2,3)12-10-8-7-9-11-13-15(4,5)6;1-17(2,3)11-7-9-13-15-16-14-10-8-12-18(4,5)6;1-2;/h7-13H2,1-6H3;7-12H2,1-6H3;1-2H2;1H4.
What are the key properties of ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane?
ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane has a molecular weight of 647.48 g/mol, XLogP of 14.17, 19 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;methane;trimethyl(7-trimethylsilylheptyl)silane;trimethyl-[3-(3-trimethylsilylpropyltetrasulfanyl)propyl]silane is sourced from PubChem (CID 157384422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).