1-bromoethoxy-ethoxy-ethyl-propylsilane

C9H21BrO2Si — CID 175040221

IUPAC1-bromoethoxy-ethoxy-ethyl-propylsilane
SMILESCCC[Si](CC)(OCC)OC(C)Br
InChIInChI=1S/C9H21BrO2Si/c1-5-8-13(7-3,11-6-2)12-9(4)10/h9H,5-8H2,1-4H3
InChIKeyAIVGXMHEWLWFGY-UHFFFAOYSA-N
MW269.25 g/mol
LogP3.65
Rot. Bonds7

About 1-bromoethoxy-ethoxy-ethyl-propylsilane

1-bromoethoxy-ethoxy-ethyl-propylsilane (PubChem CID 175040221) has the molecular formula C9H21BrO2Si and a molecular weight of 269.25 g/mol. Its IUPAC name is 1-bromoethoxy-ethoxy-ethyl-propylsilane.

Molecular Properties

Compound Name1-bromoethoxy-ethoxy-ethyl-propylsilane
PubChem CID175040221
Molecular FormulaC9H21BrO2Si
Molecular Weight269.25 g/mol
Exact Mass268.05
IUPAC Name1-bromoethoxy-ethoxy-ethyl-propylsilane
SMILESCCC[Si](CC)(OCC)OC(C)Br
InChIInChI=1S/C9H21BrO2Si/c1-5-8-13(7-3,11-6-2)12-9(4)10/h9H,5-8H2,1-4H3
InChIKeyAIVGXMHEWLWFGY-UHFFFAOYSA-N
XLogP3.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.25
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1-bromoethoxy-ethoxy-methyl-propylsilane
CID 175044219
3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine
CID 174975378
ethoxy-ethyl-[1-(2-ethyl-4-methyl-1,3-dioxolan-2-yl)ethoxy]-propylsilane
CID 141349755
3-(3-aminopropyl-ethoxy-ethylsilyl)oxybutan-1-amine
CID 141113321
3-[diethoxy(ethyl)silyl]propyl-diethoxy-ethylsilane
CID 20761011
1-(amino-ethoxy-propylsilyl)oxyethanamine
CID 175174366
diethoxy-ethyl-tetradecylsilane
CID 139614055
diethoxy-nonyl-propylsilane
CID 139614051
diethoxy-ethyl-hexacosylsilane
CID 153322873
4-[diethoxy(propyl)silyl]butan-1-amine
CID 139765357
diethoxy-ethyl-(2-triethylsilylethyl)silane
CID 87220770
chloromethyl-diethoxy-ethylsilane
CID 87219882

Frequently Asked Questions

What is the IUPAC name of 1-bromoethoxy-ethoxy-ethyl-propylsilane?
The IUPAC name of 1-bromoethoxy-ethoxy-ethyl-propylsilane (CID 175040221) is 1-bromoethoxy-ethoxy-ethyl-propylsilane.
What is the SMILES notation for 1-bromoethoxy-ethoxy-ethyl-propylsilane?
The canonical SMILES for 1-bromoethoxy-ethoxy-ethyl-propylsilane is CCC[Si](CC)(OCC)OC(C)Br.
What is the InChIKey of 1-bromoethoxy-ethoxy-ethyl-propylsilane?
The InChIKey is AIVGXMHEWLWFGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21BrO2Si/c1-5-8-13(7-3,11-6-2)12-9(4)10/h9H,5-8H2,1-4H3.
What are the key properties of 1-bromoethoxy-ethoxy-ethyl-propylsilane?
1-bromoethoxy-ethoxy-ethyl-propylsilane has a molecular weight of 269.25 g/mol, XLogP of 3.65, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromoethoxy-ethoxy-ethyl-propylsilane is sourced from PubChem (CID 175040221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).