ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane

C18H42O2Si2 — CID 11110794

IUPACethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane
SMILESCCCCCC[Si](C)(OCC)[Si](C)(CCCCCC)OCC
InChIInChI=1S/C18H42O2Si2/c1-7-11-13-15-17-21(5,19-9-3)22(6,20-10-4)18-16-14-12-8-2/h7-18H2,1-6H3
InChIKeyRLYWVOOHBLSIJL-UHFFFAOYSA-N
MW346.70 g/mol
LogP6.45
Rot. Bonds15

About ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane

ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane (PubChem CID 11110794) has the molecular formula C18H42O2Si2 and a molecular weight of 346.70 g/mol. Its IUPAC name is ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane.

Molecular Properties

Compound Nameethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane
PubChem CID11110794
Molecular FormulaC18H42O2Si2
Molecular Weight346.70 g/mol
Exact Mass346.27
IUPAC Nameethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane
SMILESCCCCCC[Si](C)(OCC)[Si](C)(CCCCCC)OCC
InChIInChI=1S/C18H42O2Si2/c1-7-11-13-15-17-21(5,19-9-3)22(6,20-10-4)18-16-14-12-8-2/h7-18H2,1-6H3
InChIKeyRLYWVOOHBLSIJL-UHFFFAOYSA-N
XLogP6.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.70
LogP ≤ 56.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

diethoxy-methyl-undecylsilane
CID 140884401
diethoxy-heptadecyl-pentadecylsilane
CID 139614360
dodecyl(triethoxy)silane;tridecane
CID 174970002
triethoxy(henicosyl)silane
CID 141362894
diethoxy-hexadecyl-tridecylsilane
CID 139614117
diethoxy-icosyl-undecylsilane
CID 139614143
decyl-diethoxy-tridecylsilane
CID 139614334
triethoxy(nonyl)silane;triethoxy(octyl)silane
CID 175508301
ethoxy-hydroxy-methyl-octylsilane
CID 87576406
triethoxy(nonyl)silane;hydrofluoride
CID 161088856
silane;triethoxy(tetradecyl)silane
CID 161365398
butyl-diethoxy-tetradecylsilane
CID 139614088

Frequently Asked Questions

What is the IUPAC name of ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane?
The IUPAC name of ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane (CID 11110794) is ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane.
What is the SMILES notation for ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane?
The canonical SMILES for ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane is CCCCCC[Si](C)(OCC)[Si](C)(CCCCCC)OCC.
What is the InChIKey of ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane?
The InChIKey is RLYWVOOHBLSIJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42O2Si2/c1-7-11-13-15-17-21(5,19-9-3)22(6,20-10-4)18-16-14-12-8-2/h7-18H2,1-6H3.
What are the key properties of ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane?
ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane has a molecular weight of 346.70 g/mol, XLogP of 6.45, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane is sourced from PubChem (CID 11110794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).