dibromo-butyl-ethoxysilane

C6H14Br2OSi — CID 140745096

IUPACdibromo-butyl-ethoxysilane
SMILESCCCC[Si](Br)(Br)OCC
InChIInChI=1S/C6H14Br2OSi/c1-3-5-6-10(7,8)9-4-2/h3-6H2,1-2H3
InChIKeyKFKYWPXXROVUPV-UHFFFAOYSA-N
MW290.07 g/mol
LogP3.55
Rot. Bonds5

About dibromo-butyl-ethoxysilane

dibromo-butyl-ethoxysilane (PubChem CID 140745096) has the molecular formula C6H14Br2OSi and a molecular weight of 290.07 g/mol. Its IUPAC name is dibromo-butyl-ethoxysilane.

Molecular Properties

Compound Namedibromo-butyl-ethoxysilane
PubChem CID140745096
Molecular FormulaC6H14Br2OSi
Molecular Weight290.07 g/mol
Exact Mass287.92
IUPAC Namedibromo-butyl-ethoxysilane
SMILESCCCC[Si](Br)(Br)OCC
InChIInChI=1S/C6H14Br2OSi/c1-3-5-6-10(7,8)9-4-2/h3-6H2,1-2H3
InChIKeyKFKYWPXXROVUPV-UHFFFAOYSA-N
XLogP3.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.07
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze dibromo-butyl-ethoxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

butyl-diethoxy-iodosilane
CID 154487050
butyl-diethoxy-tetradecylsilane
CID 139614088
dibromo-butyl-methylsilane
CID 140744808
butan-2-yl-butyl-diethoxysilane
CID 23358225
butyl(triethoxy)silane;trimethoxy(propyl)silane
CID 158050354
butyl-diethoxy-methoxysilane;molecular hydrogen
CID 161363700
butyl-chloro-ethoxy-hexylsilane
CID 140745137
triethoxy(nonyl)silane;triethoxy(octyl)silane
CID 175508301
diethoxy-heptadecyl-pentadecylsilane
CID 139614360
dodecyl(triethoxy)silane;tridecane
CID 174970002
diethoxy-hexadecyl-tridecylsilane
CID 139614117
diethoxy-icosyl-undecylsilane
CID 139614143

Frequently Asked Questions

What is the IUPAC name of dibromo-butyl-ethoxysilane?
The IUPAC name of dibromo-butyl-ethoxysilane (CID 140745096) is dibromo-butyl-ethoxysilane.
What is the SMILES notation for dibromo-butyl-ethoxysilane?
The canonical SMILES for dibromo-butyl-ethoxysilane is CCCC[Si](Br)(Br)OCC.
What is the InChIKey of dibromo-butyl-ethoxysilane?
The InChIKey is KFKYWPXXROVUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14Br2OSi/c1-3-5-6-10(7,8)9-4-2/h3-6H2,1-2H3.
What are the key properties of dibromo-butyl-ethoxysilane?
dibromo-butyl-ethoxysilane has a molecular weight of 290.07 g/mol, XLogP of 3.55, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibromo-butyl-ethoxysilane is sourced from PubChem (CID 140745096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).