dibromo-butyl-methylsilane

C5H12Br2Si — CID 140744808

IUPACdibromo-butyl-methylsilane
SMILESCCCC[Si](C)(Br)Br
InChIInChI=1S/C5H12Br2Si/c1-3-4-5-8(2,6)7/h3-5H2,1-2H3
InChIKeyQUJZCQNTQDDKMJ-UHFFFAOYSA-N
MW260.04 g/mol
LogP3.65
Rot. Bonds3

About dibromo-butyl-methylsilane

dibromo-butyl-methylsilane (PubChem CID 140744808) has the molecular formula C5H12Br2Si and a molecular weight of 260.04 g/mol. Its IUPAC name is dibromo-butyl-methylsilane.

Molecular Properties

Compound Namedibromo-butyl-methylsilane
PubChem CID140744808
Molecular FormulaC5H12Br2Si
Molecular Weight260.04 g/mol
Exact Mass257.91
IUPAC Namedibromo-butyl-methylsilane
SMILESCCCC[Si](C)(Br)Br
InChIInChI=1S/C5H12Br2Si/c1-3-4-5-8(2,6)7/h3-5H2,1-2H3
InChIKeyQUJZCQNTQDDKMJ-UHFFFAOYSA-N
XLogP3.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.04
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

dibromo-methyl-octylsilane
CID 20510451
bromo-butyl-dihexylsilane
CID 140744866
bromo-methyl-dioctylsilane
CID 140745101
bromo-dimethyl-undecylsilane
CID 87338091
N-[dibutyl(methyl)silyl]-N-ethylethanamine
CID 87363603
pentane;tetramethylsilane
CID 173025791
dibromo-butyl-ethoxysilane
CID 140745096
bromo-chloro-hexyl-methylsilane
CID 140744885
butyl-dimethyl-undecylsilane
CID 54018421
butyl-heptyl-methyl-octylsilane
CID 168803305
dibutyl-heptyl-methylsilane
CID 168803311
11-bromoundecyl-dibutyl-methylsilane
CID 162391784

Frequently Asked Questions

What is the IUPAC name of dibromo-butyl-methylsilane?
The IUPAC name of dibromo-butyl-methylsilane (CID 140744808) is dibromo-butyl-methylsilane.
What is the SMILES notation for dibromo-butyl-methylsilane?
The canonical SMILES for dibromo-butyl-methylsilane is CCCC[Si](C)(Br)Br.
What is the InChIKey of dibromo-butyl-methylsilane?
The InChIKey is QUJZCQNTQDDKMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12Br2Si/c1-3-4-5-8(2,6)7/h3-5H2,1-2H3.
What are the key properties of dibromo-butyl-methylsilane?
dibromo-butyl-methylsilane has a molecular weight of 260.04 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibromo-butyl-methylsilane is sourced from PubChem (CID 140744808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).