dibromo-ethoxy-phenoxysilane

C8H10Br2O2Si — CID 140744842

IUPACdibromo-ethoxy-phenoxysilane
SMILESCCO[Si](Br)(Br)Oc1ccccc1
InChIInChI=1S/C8H10Br2O2Si/c1-2-11-13(9,10)12-8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKeyCEGFZGXIHBLKDJ-UHFFFAOYSA-N
MW326.06 g/mol
LogP3.33
Rot. Bonds4

About dibromo-ethoxy-phenoxysilane

dibromo-ethoxy-phenoxysilane (PubChem CID 140744842) has the molecular formula C8H10Br2O2Si and a molecular weight of 326.06 g/mol. Its IUPAC name is dibromo-ethoxy-phenoxysilane.

Molecular Properties

Compound Namedibromo-ethoxy-phenoxysilane
PubChem CID140744842
Molecular FormulaC8H10Br2O2Si
Molecular Weight326.06 g/mol
Exact Mass323.88
IUPAC Namedibromo-ethoxy-phenoxysilane
SMILESCCO[Si](Br)(Br)Oc1ccccc1
InChIInChI=1S/C8H10Br2O2Si/c1-2-11-13(9,10)12-8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKeyCEGFZGXIHBLKDJ-UHFFFAOYSA-N
XLogP3.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.06
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Phenolate Sodium
CID 4445035
Hydron phenoxide
CID 20488062
Dibutyl phenyl phosphate
CID 17312
Dietholate
CID 36106
Trimethylphenoxysilane
CID 73720
Potassium phenoxide
CID 23670670
Phenoxyarsonous acid
CID 44395086
Triethylphenoxystannane
CID 16682829
Silane, dimethyldiphenoxy-
CID 76972
Diethyl phenyl phosphate
CID 17280
Phosphoric acid, dimethyl phenyl ester
CID 82355
1,4-Bis(trimethylsiloxy)benzene
CID 298121

Frequently Asked Questions

What is the IUPAC name of dibromo-ethoxy-phenoxysilane?
The IUPAC name of dibromo-ethoxy-phenoxysilane (CID 140744842) is dibromo-ethoxy-phenoxysilane.
What is the SMILES notation for dibromo-ethoxy-phenoxysilane?
The canonical SMILES for dibromo-ethoxy-phenoxysilane is CCO[Si](Br)(Br)Oc1ccccc1.
What is the InChIKey of dibromo-ethoxy-phenoxysilane?
The InChIKey is CEGFZGXIHBLKDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10Br2O2Si/c1-2-11-13(9,10)12-8-6-4-3-5-7-8/h3-7H,2H2,1H3.
What are the key properties of dibromo-ethoxy-phenoxysilane?
dibromo-ethoxy-phenoxysilane has a molecular weight of 326.06 g/mol, XLogP of 3.33, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibromo-ethoxy-phenoxysilane is sourced from PubChem (CID 140744842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).