tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane

C18H42SSi2 — CID 11163810

IUPACtri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane
SMILESCC(C)[Si](S[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H42SSi2/c1-13(2)20(14(3)4,15(5)6)19-21(16(7)8,17(9)10)18(11)12/h13-18H,1-12H3
InChIKeyKEMKTHXEACSVSU-UHFFFAOYSA-N
MW346.77 g/mol
LogP8.07
Rot. Bonds8

About tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane

tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane (PubChem CID 11163810) has the molecular formula C18H42SSi2 and a molecular weight of 346.77 g/mol. Its IUPAC name is tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane.

Molecular Properties

Compound Nametri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane
PubChem CID11163810
Molecular FormulaC18H42SSi2
Molecular Weight346.77 g/mol
Exact Mass346.25
IUPAC Nametri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane
SMILESCC(C)[Si](S[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H42SSi2/c1-13(2)20(14(3)4,15(5)6)19-21(16(7)8,17(9)10)18(11)12/h13-18H,1-12H3
InChIKeyKEMKTHXEACSVSU-UHFFFAOYSA-N
XLogP8.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.77
LogP ≤ 58.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane?
The IUPAC name of tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane (CID 11163810) is tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane.
What is the SMILES notation for tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane?
The canonical SMILES for tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane is CC(C)[Si](S[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane?
The InChIKey is KEMKTHXEACSVSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42SSi2/c1-13(2)20(14(3)4,15(5)6)19-21(16(7)8,17(9)10)18(11)12/h13-18H,1-12H3.
What are the key properties of tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane?
tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane has a molecular weight of 346.77 g/mol, XLogP of 8.07, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-tri(propan-2-yl)silylsulfanylsilane is sourced from PubChem (CID 11163810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).