[4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane

C10H20S2Si — CID 11075301

IUPAC[4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane
SMILESCSC1(SC)CC=C([Si](C)(C)C)C1
InChIInChI=1S/C10H20S2Si/c1-11-10(12-2)7-6-9(8-10)13(3,4)5/h6H,7-8H2,1-5H3
InChIKeyJVZVLBMQMHLBSK-UHFFFAOYSA-N
MW232.49 g/mol
LogP4.01
Rot. Bonds3

About [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane

[4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane (PubChem CID 11075301) has the molecular formula C10H20S2Si and a molecular weight of 232.49 g/mol. Its IUPAC name is [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane.

Molecular Properties

Compound Name[4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane
PubChem CID11075301
Molecular FormulaC10H20S2Si
Molecular Weight232.49 g/mol
Exact Mass232.08
IUPAC Name[4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane
SMILESCSC1(SC)CC=C([Si](C)(C)C)C1
InChIInChI=1S/C10H20S2Si/c1-11-10(12-2)7-6-9(8-10)13(3,4)5/h6H,7-8H2,1-5H3
InChIKeyJVZVLBMQMHLBSK-UHFFFAOYSA-N
XLogP4.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.49
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane?
The IUPAC name of [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane (CID 11075301) is [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane.
What is the SMILES notation for [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane?
The canonical SMILES for [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane is CSC1(SC)CC=C([Si](C)(C)C)C1.
What is the InChIKey of [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane?
The InChIKey is JVZVLBMQMHLBSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20S2Si/c1-11-10(12-2)7-6-9(8-10)13(3,4)5/h6H,7-8H2,1-5H3.
What are the key properties of [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane?
[4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane has a molecular weight of 232.49 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4,4-bis(methylsulfanyl)cyclopenten-1-yl]-trimethylsilane is sourced from PubChem (CID 11075301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).