1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane

C15H32O5Si — CID 140681114

IUPAC1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane
SMILESCCCO[Si](CCC)(OCCC)OC(CC)OCC1CO1
InChIInChI=1S/C15H32O5Si/c1-5-9-18-21(11-7-3,19-10-6-2)20-15(8-4)17-13-14-12-16-14/h14-15H,5-13H2,1-4H3
InChIKeyMKZVUSALSBFJST-UHFFFAOYSA-N
MW320.50 g/mol
LogP3.36
Rot. Bonds14

About 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane

1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane (PubChem CID 140681114) has the molecular formula C15H32O5Si and a molecular weight of 320.50 g/mol. Its IUPAC name is 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane.

Molecular Properties

Compound Name1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane
PubChem CID140681114
Molecular FormulaC15H32O5Si
Molecular Weight320.50 g/mol
Exact Mass320.20
IUPAC Name1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane
SMILESCCCO[Si](CCC)(OCCC)OC(CC)OCC1CO1
InChIInChI=1S/C15H32O5Si/c1-5-9-18-21(11-7-3,19-10-6-2)20-15(8-4)17-13-14-12-16-14/h14-15H,5-13H2,1-4H3
InChIKeyMKZVUSALSBFJST-UHFFFAOYSA-N
XLogP3.36
TPSA49.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.50
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

triethyl 1-(oxiran-2-ylmethoxy)propyl silicate
CID 87343649
2-(oxiran-2-ylmethoxy)propyl-tripropoxysilane
CID 22169298
methyl-[1-(oxiran-2-ylmethoxy)ethyl]-dipropoxysilane
CID 54021833
ethyl-[3-(oxiran-2-ylmethoxy)butyl]-dipropoxysilane
CID 152596309
diethoxy-[oxiran-2-ylmethoxy(triethoxysilyl)methyl]-propylsilane
CID 150689843
2-[1-(oxiran-2-ylmethoxy)pentadecoxymethyl]oxirane
CID 176729435
2-[1-(2-propoxyethoxy)propan-2-yloxymethyl]oxirane
CID 134464354
butyl-dimethyl-[1-(oxiran-2-ylmethoxy)propyl]silane
CID 87929298
1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane
CID 123534416
2-(1-ethenoxybutoxymethyl)oxirane
CID 87772830
2-[[1-ethoxy-2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]methyl]oxirane
CID 150746086
butan-2-yloxy-diethoxy-[2-(oxiran-2-yl)ethyl]silane
CID 175371558

Frequently Asked Questions

What is the IUPAC name of 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane?
The IUPAC name of 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane (CID 140681114) is 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane.
What is the SMILES notation for 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane?
The canonical SMILES for 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane is CCCO[Si](CCC)(OCCC)OC(CC)OCC1CO1.
What is the InChIKey of 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane?
The InChIKey is MKZVUSALSBFJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O5Si/c1-5-9-18-21(11-7-3,19-10-6-2)20-15(8-4)17-13-14-12-16-14/h14-15H,5-13H2,1-4H3.
What are the key properties of 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane?
1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane has a molecular weight of 320.50 g/mol, XLogP of 3.36, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxiran-2-ylmethoxy)propoxy-dipropoxy-propylsilane is sourced from PubChem (CID 140681114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).