trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane

C18H42O8Si4 — CID 162697457

IUPACtrimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane
SMILESCO[Si](CC[Si]1(C)CCCCO[Si](C)(CCCOCC2CO2)O[SiH](C)O1)(OC)OC
InChIInChI=1S/C18H42O8Si4/c1-19-30(20-2,21-3)15-14-28(5)12-8-7-11-24-29(6,26-27(4)25-28)13-9-10-22-16-18-17-23-18/h18,27H,7-17H2,1-6H3
InChIKeyFXDPCRJQBDQUQP-UHFFFAOYSA-N
MW498.87 g/mol
LogP3.01
Rot. Bonds12

About trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane

trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane (PubChem CID 162697457) has the molecular formula C18H42O8Si4 and a molecular weight of 498.87 g/mol. Its IUPAC name is trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane.

Molecular Properties

Compound Nametrimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane
PubChem CID162697457
Molecular FormulaC18H42O8Si4
Molecular Weight498.87 g/mol
Exact Mass498.20
IUPAC Nametrimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane
SMILESCO[Si](CC[Si]1(C)CCCCO[Si](C)(CCCOCC2CO2)O[SiH](C)O1)(OC)OC
InChIInChI=1S/C18H42O8Si4/c1-19-30(20-2,21-3)15-14-28(5)12-8-7-11-24-29(6,26-27(4)25-28)13-9-10-22-16-18-17-23-18/h18,27H,7-17H2,1-6H3
InChIKeyFXDPCRJQBDQUQP-UHFFFAOYSA-N
XLogP3.01
TPSA77.14 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500498.87
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane?
The IUPAC name of trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane (CID 162697457) is trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane.
What is the SMILES notation for trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane?
The canonical SMILES for trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane is CO[Si](CC[Si]1(C)CCCCO[Si](C)(CCCOCC2CO2)O[SiH](C)O1)(OC)OC.
What is the InChIKey of trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane?
The InChIKey is FXDPCRJQBDQUQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42O8Si4/c1-19-30(20-2,21-3)15-14-28(5)12-8-7-11-24-29(6,26-27(4)25-28)13-9-10-22-16-18-17-23-18/h18,27H,7-17H2,1-6H3.
What are the key properties of trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane?
trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane has a molecular weight of 498.87 g/mol, XLogP of 3.01, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane is sourced from PubChem (CID 162697457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).