di(hexan-3-yloxy)-sulfanylidenesilane

C12H26O2SSi — CID 57259552

IUPACdi(hexan-3-yloxy)-sulfanylidenesilane
SMILESCCCC(CC)O[Si](=S)OC(CC)CCC
InChIInChI=1S/C12H26O2SSi/c1-5-9-11(7-3)13-16(15)14-12(8-4)10-6-2/h11-12H,5-10H2,1-4H3
InChIKeyLWZXWTYWEGJZBN-UHFFFAOYSA-N
MW262.49 g/mol
LogP4.36
Rot. Bonds10

About di(hexan-3-yloxy)-sulfanylidenesilane

di(hexan-3-yloxy)-sulfanylidenesilane (PubChem CID 57259552) has the molecular formula C12H26O2SSi and a molecular weight of 262.49 g/mol. Its IUPAC name is di(hexan-3-yloxy)-sulfanylidenesilane.

Molecular Properties

Compound Namedi(hexan-3-yloxy)-sulfanylidenesilane
PubChem CID57259552
Molecular FormulaC12H26O2SSi
Molecular Weight262.49 g/mol
Exact Mass262.14
IUPAC Namedi(hexan-3-yloxy)-sulfanylidenesilane
SMILESCCCC(CC)O[Si](=S)OC(CC)CCC
InChIInChI=1S/C12H26O2SSi/c1-5-9-11(7-3)13-16(15)14-12(8-4)10-6-2/h11-12H,5-10H2,1-4H3
InChIKeyLWZXWTYWEGJZBN-UHFFFAOYSA-N
XLogP4.36
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.49
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of di(hexan-3-yloxy)-sulfanylidenesilane?
The IUPAC name of di(hexan-3-yloxy)-sulfanylidenesilane (CID 57259552) is di(hexan-3-yloxy)-sulfanylidenesilane.
What is the SMILES notation for di(hexan-3-yloxy)-sulfanylidenesilane?
The canonical SMILES for di(hexan-3-yloxy)-sulfanylidenesilane is CCCC(CC)O[Si](=S)OC(CC)CCC.
What is the InChIKey of di(hexan-3-yloxy)-sulfanylidenesilane?
The InChIKey is LWZXWTYWEGJZBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2SSi/c1-5-9-11(7-3)13-16(15)14-12(8-4)10-6-2/h11-12H,5-10H2,1-4H3.
What are the key properties of di(hexan-3-yloxy)-sulfanylidenesilane?
di(hexan-3-yloxy)-sulfanylidenesilane has a molecular weight of 262.49 g/mol, XLogP of 4.36, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for di(hexan-3-yloxy)-sulfanylidenesilane is sourced from PubChem (CID 57259552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).