3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol

C15H40O6Si4 — CID 123755721

IUPAC3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol
SMILESC[Si](C)(CCCO)O[SiH](O[Si](C)(C)CCCO)O[Si](C)(C)CCCO
InChIInChI=1S/C15H40O6Si4/c1-23(2,13-7-10-16)19-22(20-24(3,4)14-8-11-17)21-25(5,6)15-9-12-18/h16-18,22H,7-15H2,1-6H3
InChIKeyZZYUJAHQEHQTBK-UHFFFAOYSA-N
MW428.82 g/mol
LogP2.52
Rot. Bonds15

About 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol

3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol (PubChem CID 123755721) has the molecular formula C15H40O6Si4 and a molecular weight of 428.82 g/mol. Its IUPAC name is 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol.

Molecular Properties

Compound Name3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol
PubChem CID123755721
Molecular FormulaC15H40O6Si4
Molecular Weight428.82 g/mol
Exact Mass428.19
IUPAC Name3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol
SMILESC[Si](C)(CCCO)O[SiH](O[Si](C)(C)CCCO)O[Si](C)(C)CCCO
InChIInChI=1S/C15H40O6Si4/c1-23(2,13-7-10-16)19-22(20-24(3,4)14-8-11-17)21-25(5,6)15-9-12-18/h16-18,22H,7-15H2,1-6H3
InChIKeyZZYUJAHQEHQTBK-UHFFFAOYSA-N
XLogP2.52
TPSA88.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.82
LogP ≤ 52.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol?
The IUPAC name of 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol (CID 123755721) is 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol.
What is the SMILES notation for 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol?
The canonical SMILES for 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol is C[Si](C)(CCCO)O[SiH](O[Si](C)(C)CCCO)O[Si](C)(C)CCCO.
What is the InChIKey of 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol?
The InChIKey is ZZYUJAHQEHQTBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H40O6Si4/c1-23(2,13-7-10-16)19-22(20-24(3,4)14-8-11-17)21-25(5,6)15-9-12-18/h16-18,22H,7-15H2,1-6H3.
What are the key properties of 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol?
3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol has a molecular weight of 428.82 g/mol, XLogP of 2.52, 15 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[bis[[3-hydroxypropyl(dimethyl)silyl]oxy]silyloxy-dimethylsilyl]propan-1-ol is sourced from PubChem (CID 123755721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).