1-bromoethoxy-ethoxy-methyl-propylsilane

C8H19BrO2Si — CID 175044219

IUPAC1-bromoethoxy-ethoxy-methyl-propylsilane
SMILESCCC[Si](C)(OCC)OC(C)Br
InChIInChI=1S/C8H19BrO2Si/c1-5-7-12(4,10-6-2)11-8(3)9/h8H,5-7H2,1-4H3
InChIKeyADSBNCRIMJCRPZ-UHFFFAOYSA-N
MW255.23 g/mol
LogP3.26
Rot. Bonds6

About 1-bromoethoxy-ethoxy-methyl-propylsilane

1-bromoethoxy-ethoxy-methyl-propylsilane (PubChem CID 175044219) has the molecular formula C8H19BrO2Si and a molecular weight of 255.23 g/mol. Its IUPAC name is 1-bromoethoxy-ethoxy-methyl-propylsilane.

Molecular Properties

Compound Name1-bromoethoxy-ethoxy-methyl-propylsilane
PubChem CID175044219
Molecular FormulaC8H19BrO2Si
Molecular Weight255.23 g/mol
Exact Mass254.03
IUPAC Name1-bromoethoxy-ethoxy-methyl-propylsilane
SMILESCCC[Si](C)(OCC)OC(C)Br
InChIInChI=1S/C8H19BrO2Si/c1-5-7-12(4,10-6-2)11-8(3)9/h8H,5-7H2,1-4H3
InChIKeyADSBNCRIMJCRPZ-UHFFFAOYSA-N
XLogP3.26
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 53.26
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-ethyl-propylsilane
CID 175040221
ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane
CID 159005238
1-(amino-ethoxy-propylsilyl)oxyethanamine
CID 175174366
ethoxy-methyl-octyl-propan-2-yloxysilane
CID 175038920
ethoxy-methyl-(1-piperazin-1-ylethoxy)-propylsilane
CID 175455488
4-bromobutyl-(1-chloroethoxy)-ethoxy-methylsilane
CID 141486551
ethoxy-methyl-(1-morpholin-2-ylethoxy)-propylsilane
CID 174627480
1-(ethoxy-methoxy-propylsilyl)oxyethanamine
CID 87663977
[diethoxy(methyl)silyl]methyl-diethoxy-methylsilane
CID 13131406
diethoxy-[[ethoxy(dimethyl)silyl]methyl]-methylsilane
CID 58151745
diethoxy-methyl-undecylsilane
CID 140884401
chloro-ethoxy-methyl-propylsilane
CID 141340520

Frequently Asked Questions

What is the IUPAC name of 1-bromoethoxy-ethoxy-methyl-propylsilane?
The IUPAC name of 1-bromoethoxy-ethoxy-methyl-propylsilane (CID 175044219) is 1-bromoethoxy-ethoxy-methyl-propylsilane.
What is the SMILES notation for 1-bromoethoxy-ethoxy-methyl-propylsilane?
The canonical SMILES for 1-bromoethoxy-ethoxy-methyl-propylsilane is CCC[Si](C)(OCC)OC(C)Br.
What is the InChIKey of 1-bromoethoxy-ethoxy-methyl-propylsilane?
The InChIKey is ADSBNCRIMJCRPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19BrO2Si/c1-5-7-12(4,10-6-2)11-8(3)9/h8H,5-7H2,1-4H3.
What are the key properties of 1-bromoethoxy-ethoxy-methyl-propylsilane?
1-bromoethoxy-ethoxy-methyl-propylsilane has a molecular weight of 255.23 g/mol, XLogP of 3.26, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromoethoxy-ethoxy-methyl-propylsilane is sourced from PubChem (CID 175044219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).