[1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane

C14H38O4S4Si4 — CID 87625325

IUPAC[1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane
SMILESCCC(SSSSC(CC)([Si](C)(C)O)[Si](C)(C)O)([Si](C)(C)O)[Si](C)(C)O
InChIInChI=1S/C14H38O4S4Si4/c1-11-13(23(3,4)15,24(5,6)16)19-21-22-20-14(12-2,25(7,8)17)26(9,10)18/h15-18H,11-12H2,1-10H3
InChIKeyQBPOVVJYRLIWCB-UHFFFAOYSA-N
MW511.07 g/mol
LogP4.91
Rot. Bonds11

About [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane

[1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane (PubChem CID 87625325) has the molecular formula C14H38O4S4Si4 and a molecular weight of 511.07 g/mol. Its IUPAC name is [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane.

Molecular Properties

Compound Name[1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane
PubChem CID87625325
Molecular FormulaC14H38O4S4Si4
Molecular Weight511.07 g/mol
Exact Mass510.07
IUPAC Name[1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane
SMILESCCC(SSSSC(CC)([Si](C)(C)O)[Si](C)(C)O)([Si](C)(C)O)[Si](C)(C)O
InChIInChI=1S/C14H38O4S4Si4/c1-11-13(23(3,4)15,24(5,6)16)19-21-22-20-14(12-2,25(7,8)17)26(9,10)18/h15-18H,11-12H2,1-10H3
InChIKeyQBPOVVJYRLIWCB-UHFFFAOYSA-N
XLogP4.91
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500511.07
LogP ≤ 54.91
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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'}

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Related Compounds

Hydroxy-[3-[3-[hydroxy(dimethyl)silyl]propyltetrasulfanyl]propyl]-dimethylsilane
CID 85819107
Hydroxy-[1-[1-[hydroxy(dimethyl)silyl]propyltetrasulfanyl]propyl]-dimethylsilane
CID 87469555
2-[[Dimethyl(trimethylsilyloxy)silyl]methyldisulfanyl]propan-2-yl-dimethyl-trimethylsilyloxysilane
CID 139946326
[1-(Disulfanyl)-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane
CID 173639769
[3-[3,3-Bis[hydroxy(dimethyl)silyl]propyldisulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane
CID 173937679

Frequently Asked Questions

What is the IUPAC name of [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane?
The IUPAC name of [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane (CID 87625325) is [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane.
What is the SMILES notation for [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane?
The canonical SMILES for [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane is CCC(SSSSC(CC)([Si](C)(C)O)[Si](C)(C)O)([Si](C)(C)O)[Si](C)(C)O.
What is the InChIKey of [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane?
The InChIKey is QBPOVVJYRLIWCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H38O4S4Si4/c1-11-13(23(3,4)15,24(5,6)16)19-21-22-20-14(12-2,25(7,8)17)26(9,10)18/h15-18H,11-12H2,1-10H3.
What are the key properties of [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane?
[1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane has a molecular weight of 511.07 g/mol, XLogP of 4.91, 11 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1,1-bis[hydroxy(dimethyl)silyl]propyltetrasulfanyl]-1-[hydroxy(dimethyl)silyl]propyl]-hydroxy-dimethylsilane is sourced from PubChem (CID 87625325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).