[1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane

C18H34O6Si2 — CID 174862070

IUPAC[1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane
SMILESCOC(C)(OC)C([SiH3])(OC)c1ccc(C([SiH3])(OC)C(C)(OC)OC)cc1
InChIInChI=1S/C18H34O6Si2/c1-15(19-3,20-4)17(25,23-7)13-9-11-14(12-10-13)18(26,24-8)16(2,21-5)22-6/h9-12H,1-8,25-26H3
InChIKeyULIFOZNMRLUMDZ-UHFFFAOYSA-N
MW402.64 g/mol
LogP0.03
Rot. Bonds10

About [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane

[1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane (PubChem CID 174862070) has the molecular formula C18H34O6Si2 and a molecular weight of 402.64 g/mol. Its IUPAC name is [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane.

Molecular Properties

Compound Name[1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane
PubChem CID174862070
Molecular FormulaC18H34O6Si2
Molecular Weight402.64 g/mol
Exact Mass402.19
IUPAC Name[1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane
SMILESCOC(C)(OC)C([SiH3])(OC)c1ccc(C([SiH3])(OC)C(C)(OC)OC)cc1
InChIInChI=1S/C18H34O6Si2/c1-15(19-3,20-4)17(25,23-7)13-9-11-14(12-10-13)18(26,24-8)16(2,21-5)22-6/h9-12H,1-8,25-26H3
InChIKeyULIFOZNMRLUMDZ-UHFFFAOYSA-N
XLogP0.03
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.64
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane?
The IUPAC name of [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane (CID 174862070) is [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane.
What is the SMILES notation for [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane?
The canonical SMILES for [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane is COC(C)(OC)C([SiH3])(OC)c1ccc(C([SiH3])(OC)C(C)(OC)OC)cc1.
What is the InChIKey of [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane?
The InChIKey is ULIFOZNMRLUMDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O6Si2/c1-15(19-3,20-4)17(25,23-7)13-9-11-14(12-10-13)18(26,24-8)16(2,21-5)22-6/h9-12H,1-8,25-26H3.
What are the key properties of [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane?
[1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane has a molecular weight of 402.64 g/mol, XLogP of 0.03, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane is sourced from PubChem (CID 174862070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).