2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane

C19H38O5Si2 — CID 87580105

IUPAC2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane
SMILESC[Si]1(C)CCC(CCCOCC2CO2)(CCCOCC2CO2)O[Si]1(C)C
InChIInChI=1S/C19H38O5Si2/c1-25(2)12-9-19(24-26(25,3)4,7-5-10-20-13-17-15-22-17)8-6-11-21-14-18-16-23-18/h17-18H,5-16H2,1-4H3
InChIKeyQSJLEECVTLNXPM-UHFFFAOYSA-N
MW402.68 g/mol
LogP3.53
Rot. Bonds12

About 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane

2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane (PubChem CID 87580105) has the molecular formula C19H38O5Si2 and a molecular weight of 402.68 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane
PubChem CID87580105
Molecular FormulaC19H38O5Si2
Molecular Weight402.68 g/mol
Exact Mass402.23
IUPAC Name2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane
SMILESC[Si]1(C)CCC(CCCOCC2CO2)(CCCOCC2CO2)O[Si]1(C)C
InChIInChI=1S/C19H38O5Si2/c1-25(2)12-9-19(24-26(25,3)4,7-5-10-20-13-17-15-22-17)8-6-11-21-14-18-16-23-18/h17-18H,5-16H2,1-4H3
InChIKeyQSJLEECVTLNXPM-UHFFFAOYSA-N
XLogP3.53
TPSA52.75 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.68
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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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Related Compounds

2-[4-[4-[4-[4-[4-[4-[4-[4-[4-(oxiran-2-ylmethoxy)butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxymethyl]oxirane
CID 130476685
2-[18-(oxiran-2-ylmethoxy)octadecoxymethyl]oxirane
CID 172718038
2-[4-[4-[4-(oxiran-2-ylmethoxy)butoxy]butoxy]butoxymethyl]oxirane
CID 130476668
(2R)-2-(3-methoxypropoxymethyl)oxirane
CID 130493223
2-(4-methoxybutoxymethyl)oxirane
CID 58151519
2-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxymethyl]oxirane
CID 91036446
2-(pentoxymethyl)oxirane
CID 160890113
CID 166063430
CID 166063430
2-(decoxymethyl)oxirane;2-(nonoxymethyl)oxirane;2-(octoxymethyl)oxirane
CID 71311396
2-[3-[2-(3-methoxypropoxy)ethoxy]propoxymethyl]oxirane
CID 101393644
2-(octoxymethyl)oxirane;2-(tetradecoxymethyl)oxirane
CID 174518537
2-(hexoxymethyl)oxirane;2-(pentoxymethyl)oxirane
CID 159895637

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane?
The IUPAC name of 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane (CID 87580105) is 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane.
What is the SMILES notation for 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane?
The canonical SMILES for 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane is C[Si]1(C)CCC(CCCOCC2CO2)(CCCOCC2CO2)O[Si]1(C)C.
What is the InChIKey of 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane?
The InChIKey is QSJLEECVTLNXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38O5Si2/c1-25(2)12-9-19(24-26(25,3)4,7-5-10-20-13-17-15-22-17)8-6-11-21-14-18-16-23-18/h17-18H,5-16H2,1-4H3.
What are the key properties of 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane?
2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane has a molecular weight of 402.68 g/mol, XLogP of 3.53, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane is sourced from PubChem (CID 87580105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).