diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane

C20H44O9Si2 — CID 173170061

IUPACdiethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
SMILESCCO[SiH](CCCCOCC1CO1)OCC.CO[Si](CCCOCC1CO1)(OC)OC
InChIInChI=1S/C11H24O4Si.C9H20O5Si/c1-3-14-16(15-4-2)8-6-5-7-12-9-11-10-13-11;1-10-15(11-2,12-3)6-4-5-13-7-9-8-14-9/h11,16H,3-10H2,1-2H3;9H,4-8H2,1-3H3
InChIKeyWOWYCCAIFBWOPL-UHFFFAOYSA-N
MW484.74 g/mol
LogP2.15
Rot. Bonds20

About diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane

diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane (PubChem CID 173170061) has the molecular formula C20H44O9Si2 and a molecular weight of 484.74 g/mol. Its IUPAC name is diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane.

Molecular Properties

Compound Namediethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
PubChem CID173170061
Molecular FormulaC20H44O9Si2
Molecular Weight484.74 g/mol
Exact Mass484.25
IUPAC Namediethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
SMILESCCO[SiH](CCCCOCC1CO1)OCC.CO[Si](CCCOCC1CO1)(OC)OC
InChIInChI=1S/C11H24O4Si.C9H20O5Si/c1-3-14-16(15-4-2)8-6-5-7-12-9-11-10-13-11;1-10-15(11-2,12-3)6-4-5-13-7-9-8-14-9/h11,16H,3-10H2,1-2H3;9H,4-8H2,1-3H3
InChIKeyWOWYCCAIFBWOPL-UHFFFAOYSA-N
XLogP2.15
TPSA89.67 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds20
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.74
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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

ethoxysilane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 161088311
oxiran-2-ylmethoxysilane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 159211950
dimethoxy-[7-(oxiran-2-ylmethoxy)heptyl]silane
CID 173197488
butan-2-one;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 174775957
benzyl(diethoxy)silane;diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane
CID 173125357
trimethoxy-[2-(oxiran-2-ylmethoxy)ethyl]silane
CID 10130712
diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 173010804
2-[2-hydroxyethoxy-methoxy-[3-(oxiran-2-ylmethoxy)propyl]silyl]oxyethanol
CID 87722976
dimethoxy-(2-methylpropoxy)-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 169273482
1,1-dimethoxyethoxy-methoxy-[4-(oxiran-2-ylmethoxy)butoxy]-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 150839011
triethoxy(phenyl)silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 87370600
propane-1-thiol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 174889951

Frequently Asked Questions

What is the IUPAC name of diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane?
The IUPAC name of diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane (CID 173170061) is diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane.
What is the SMILES notation for diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane?
The canonical SMILES for diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane is CCO[SiH](CCCCOCC1CO1)OCC.CO[Si](CCCOCC1CO1)(OC)OC.
What is the InChIKey of diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane?
The InChIKey is WOWYCCAIFBWOPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4Si.C9H20O5Si/c1-3-14-16(15-4-2)8-6-5-7-12-9-11-10-13-11;1-10-15(11-2,12-3)6-4-5-13-7-9-8-14-9/h11,16H,3-10H2,1-2H3;9H,4-8H2,1-3H3.
What are the key properties of diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane?
diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane has a molecular weight of 484.74 g/mol, XLogP of 2.15, 20 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-[4-(oxiran-2-ylmethoxy)butyl]silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane is sourced from PubChem (CID 173170061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).