[3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol

C15H36O6Si2 — CID 140774920

IUPAC[3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol
SMILESCO[Si](C)(CCCOCC(C)OCCC[Si](C)(CO)CO)OC
InChIInChI=1S/C15H36O6Si2/c1-15(21-9-7-10-22(4,13-16)14-17)12-20-8-6-11-23(5,18-2)19-3/h15-17H,6-14H2,1-5H3
InChIKeyULDAGRXBMTWFPB-UHFFFAOYSA-N
MW368.62 g/mol
LogP1.69
Rot. Bonds15

About [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol

[3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol (PubChem CID 140774920) has the molecular formula C15H36O6Si2 and a molecular weight of 368.62 g/mol. Its IUPAC name is [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol.

Molecular Properties

Compound Name[3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol
PubChem CID140774920
Molecular FormulaC15H36O6Si2
Molecular Weight368.62 g/mol
Exact Mass368.21
IUPAC Name[3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol
SMILESCO[Si](C)(CCCOCC(C)OCCC[Si](C)(CO)CO)OC
InChIInChI=1S/C15H36O6Si2/c1-15(21-9-7-10-22(4,13-16)14-17)12-20-8-6-11-23(5,18-2)19-3/h15-17H,6-14H2,1-5H3
InChIKeyULDAGRXBMTWFPB-UHFFFAOYSA-N
XLogP1.69
TPSA77.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.62
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol?
The IUPAC name of [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol (CID 140774920) is [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol.
What is the SMILES notation for [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol?
The canonical SMILES for [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol is CO[Si](C)(CCCOCC(C)OCCC[Si](C)(CO)CO)OC.
What is the InChIKey of [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol?
The InChIKey is ULDAGRXBMTWFPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36O6Si2/c1-15(21-9-7-10-22(4,13-16)14-17)12-20-8-6-11-23(5,18-2)19-3/h15-17H,6-14H2,1-5H3.
What are the key properties of [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol?
[3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol has a molecular weight of 368.62 g/mol, XLogP of 1.69, 15 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[1-[3-[dimethoxy(methyl)silyl]propoxy]propan-2-yloxy]propyl-(hydroxymethyl)-methylsilyl]methanol is sourced from PubChem (CID 140774920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).