(1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane

C26H58O3Si2 — CID 91733516

IUPAC(1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane
SMILESCCCCCCCCCCCCCCCCCOCC(CO[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C26H58O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-24-26(29-31(5,6)7)25-28-30(2,3)4/h26H,8-25H2,1-7H3
InChIKeyGLOKYLJPCHWUBB-UHFFFAOYSA-N
MW474.92 g/mol
LogP8.95
Rot. Bonds23

About (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane

(1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane (PubChem CID 91733516) has the molecular formula C26H58O3Si2 and a molecular weight of 474.92 g/mol. Its IUPAC name is (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane
PubChem CID91733516
Molecular FormulaC26H58O3Si2
Molecular Weight474.92 g/mol
Exact Mass474.39
IUPAC Name(1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane
SMILESCCCCCCCCCCCCCCCCCOCC(CO[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C26H58O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-24-26(29-31(5,6)7)25-28-30(2,3)4/h26H,8-25H2,1-7H3
InChIKeyGLOKYLJPCHWUBB-UHFFFAOYSA-N
XLogP8.95
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds23
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.92
LogP ≤ 58.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,3-bis[2,3-bis(trimethylsilyloxy)propoxy]propan-2-yloxy-trimethylsilane
CID 91696506
3-[2,3-bis(trimethylsilyloxy)propoxy]propyl-chloro-dimethylsilane
CID 22137822
2,3-bis(trimethylsilyloxy)propyl nonadecanoate
CID 634380
2-[2-(2-decoxyethoxy)ethoxy]ethoxy-trimethylsilane
CID 526726
trimethyl(1-trimethylsilyloxypentan-2-yloxy)silane
CID 142414761
trimethyl(1-trimethylsilyloxyoctan-3-yloxy)silane
CID 14213504
1-[2,3-di(octacosoxy)propoxy]octacosane
CID 139785017
1-(3-hexoxy-2-methoxypropoxy)hexane
CID 163381100
1-[2,3-di(tridecoxy)propoxy]tridecane
CID 71331054
1-(2-dodecoxydecoxy)dodecane
CID 175347971
trimethyl-[1,4,5-tris(trimethylsilyloxy)pentan-2-yloxy]silane
CID 553544
1-(2-methylpropoxy)tridecane
CID 91526471

Frequently Asked Questions

What is the IUPAC name of (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane?
The IUPAC name of (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane (CID 91733516) is (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane.
What is the SMILES notation for (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane?
The canonical SMILES for (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane is CCCCCCCCCCCCCCCCCOCC(CO[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane?
The InChIKey is GLOKYLJPCHWUBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H58O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-24-26(29-31(5,6)7)25-28-30(2,3)4/h26H,8-25H2,1-7H3.
What are the key properties of (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane?
(1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane has a molecular weight of 474.92 g/mol, XLogP of 8.95, 23 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-heptadecoxy-3-trimethylsilyloxypropan-2-yl)oxy-trimethylsilane is sourced from PubChem (CID 91733516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).