diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane

C20H44O9Si2 — CID 173350815

IUPACdiethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane
SMILESCCC(OCC1CO1)[Si](OC)(OC)OC.CCO[SiH](CC(CC)OCC1CO1)OCC
InChIInChI=1S/C11H24O4Si.C9H20O5Si/c1-4-10(12-7-11-8-13-11)9-16(14-5-2)15-6-3;1-5-9(14-7-8-6-13-8)15(10-2,11-3)12-4/h10-11,16H,4-9H2,1-3H3;8-9H,5-7H2,1-4H3
InChIKeyODOTZRASGLLVRG-UHFFFAOYSA-N
MW484.74 g/mol
LogP2.07
Rot. Bonds18

About diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane

diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane (PubChem CID 173350815) has the molecular formula C20H44O9Si2 and a molecular weight of 484.74 g/mol. Its IUPAC name is diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane.

Molecular Properties

Compound Namediethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane
PubChem CID173350815
Molecular FormulaC20H44O9Si2
Molecular Weight484.74 g/mol
Exact Mass484.25
IUPAC Namediethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane
SMILESCCC(OCC1CO1)[Si](OC)(OC)OC.CCO[SiH](CC(CC)OCC1CO1)OCC
InChIInChI=1S/C11H24O4Si.C9H20O5Si/c1-4-10(12-7-11-8-13-11)9-16(14-5-2)15-6-3;1-5-9(14-7-8-6-13-8)15(10-2,11-3)12-4/h10-11,16H,4-9H2,1-3H3;8-9H,5-7H2,1-4H3
InChIKeyODOTZRASGLLVRG-UHFFFAOYSA-N
XLogP2.07
TPSA89.67 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.74
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

CID 18963637
CID 18963637
triethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane
CID 87862101
lithium;butane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane
CID 174857617
diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 173010804
2-(oxiran-2-ylmethoxy)butyl-diphenoxysilane
CID 173281552
CID 18963638
CID 18963638
2-(1-chlorobutan-2-yloxymethyl)oxirane
CID 58763744
trimethoxy-[6-(oxiran-2-ylmethoxy)oct-1-enyl]silane
CID 174679686
butyl-dimethyl-[1-(oxiran-2-ylmethoxy)propyl]silane
CID 87929298
trimethoxy-[6-(oxiran-2-ylmethoxy)heptan-3-yl]silane
CID 89312307
4-(oxiran-2-ylmethoxy)hexylsilane
CID 174850618
2-[1-[4-[2-(oxiran-2-ylmethoxy)butyl]phenyl]butan-2-yloxymethyl]oxirane
CID 174820293

Frequently Asked Questions

What is the IUPAC name of diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane?
The IUPAC name of diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane (CID 173350815) is diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane.
What is the SMILES notation for diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane?
The canonical SMILES for diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane is CCC(OCC1CO1)[Si](OC)(OC)OC.CCO[SiH](CC(CC)OCC1CO1)OCC.
What is the InChIKey of diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane?
The InChIKey is ODOTZRASGLLVRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4Si.C9H20O5Si/c1-4-10(12-7-11-8-13-11)9-16(14-5-2)15-6-3;1-5-9(14-7-8-6-13-8)15(10-2,11-3)12-4/h10-11,16H,4-9H2,1-3H3;8-9H,5-7H2,1-4H3.
What are the key properties of diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane?
diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane has a molecular weight of 484.74 g/mol, XLogP of 2.07, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane is sourced from PubChem (CID 173350815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).