1-Diphenylsilyloxypentadecane

C27H41OSi — CID 6329518

IUPAC—
SMILESCCCCCCCCCCCCCCCO[Si](c1ccccc1)c1ccccc1
InChIInChI=1S/C27H41OSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-25-28-29(26-21-16-14-17-22-26)27-23-18-15-19-24-27/h14-19,21-24H,2-13,20,25H2,1H3
InChIKeyMCOBOYVXAGNRRM-UHFFFAOYSA-N
MW409.71 g/mol
LogP6.90
Rot. Bonds17

About 1-Diphenylsilyloxypentadecane

1-Diphenylsilyloxypentadecane (PubChem CID 6329518) has the molecular formula C27H41OSi and a molecular weight of 409.71 g/mol.

Molecular Properties

Compound Name1-Diphenylsilyloxypentadecane
PubChem CID6329518
Molecular FormulaC27H41OSi
Molecular Weight409.71 g/mol
Exact Mass409.29
IUPAC Name—
SMILESCCCCCCCCCCCCCCCO[Si](c1ccccc1)c1ccccc1
InChIInChI=1S/C27H41OSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-25-28-29(26-21-16-14-17-22-26)27-23-18-15-19-24-27/h14-19,21-24H,2-13,20,25H2,1H3
InChIKeyMCOBOYVXAGNRRM-UHFFFAOYSA-N
XLogP6.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds17
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.71
LogP ≤ 56.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

CID 22294455
CID 22294455
CID 22294452
CID 22294452
fluorobenzene;1-hexoxyhexane
CID 174664464
azane;hexoxymethylbenzene
CID 174805489
2-hexadecoxyethoxymethylbenzene
CID 19965709
5-(2-hexoxyethoxy)pentoxymethylbenzene
CID 160938924
2-(2-heptoxyethoxy)ethoxymethylbenzene
CID 123339460
2-dodecoxyethoxymethylbenzene
CID 12857482
pentoxybenzene;undecane
CID 174778179
Dihexyl(phenyl)silane
CID 10923838
CID 45050202
CID 45050202
dihexadecoxy(phenyl)silane
CID 173048581

Frequently Asked Questions

What is the IUPAC name of 1-Diphenylsilyloxypentadecane?
The IUPAC name of 1-Diphenylsilyloxypentadecane (CID 6329518) is not available.
What is the SMILES notation for 1-Diphenylsilyloxypentadecane?
The canonical SMILES for 1-Diphenylsilyloxypentadecane is CCCCCCCCCCCCCCCO[Si](c1ccccc1)c1ccccc1.
What is the InChIKey of 1-Diphenylsilyloxypentadecane?
The InChIKey is MCOBOYVXAGNRRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H41OSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-25-28-29(26-21-16-14-17-22-26)27-23-18-15-19-24-27/h14-19,21-24H,2-13,20,25H2,1H3.
What are the key properties of 1-Diphenylsilyloxypentadecane?
1-Diphenylsilyloxypentadecane has a molecular weight of 409.71 g/mol, XLogP of 6.90, 17 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-Diphenylsilyloxypentadecane is sourced from PubChem (CID 6329518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).