11-bromoundecyl-dibutyl-methylsilane

C20H43BrSi — CID 162391784

IUPAC11-bromoundecyl-dibutyl-methylsilane
SMILESCCCC[Si](C)(CCCC)CCCCCCCCCCCBr
InChIInChI=1S/C20H43BrSi/c1-4-6-18-22(3,19-7-5-2)20-16-14-12-10-8-9-11-13-15-17-21/h4-20H2,1-3H3
InChIKeyQUXBHNZLKXKLQT-UHFFFAOYSA-N
MW391.55 g/mol
LogP8.57
Rot. Bonds17

About 11-bromoundecyl-dibutyl-methylsilane

11-bromoundecyl-dibutyl-methylsilane (PubChem CID 162391784) has the molecular formula C20H43BrSi and a molecular weight of 391.55 g/mol. Its IUPAC name is 11-bromoundecyl-dibutyl-methylsilane.

Molecular Properties

Compound Name11-bromoundecyl-dibutyl-methylsilane
PubChem CID162391784
Molecular FormulaC20H43BrSi
Molecular Weight391.55 g/mol
Exact Mass390.23
IUPAC Name11-bromoundecyl-dibutyl-methylsilane
SMILESCCCC[Si](C)(CCCC)CCCCCCCCCCCBr
InChIInChI=1S/C20H43BrSi/c1-4-6-18-22(3,19-7-5-2)20-16-14-12-10-8-9-11-13-15-17-21/h4-20H2,1-3H3
InChIKeyQUXBHNZLKXKLQT-UHFFFAOYSA-N
XLogP8.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.55
LogP ≤ 58.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

butyl-heptyl-methyl-octylsilane
CID 168803305
dibutyl-heptyl-methylsilane
CID 168803311
decyl-hexadecyl-methyl-octylsilane
CID 14474508
1-bromobutane;1,6-dibromohexane
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1-bromononadecane
CID 20496
1-bromooctane
CID 159764808
1-bromooctadecane
CID 8218
6-bromohexoxy-butyl-dimethylsilane
CID 154264730
1-bromohexadecane;methane
CID 174415075
6-[dihexyl(methyl)silyl]hexan-1-amine
CID 132992433
magnesium;1-bromopentadecane;hydride
CID 173122979
20-bromoicosyl-chloro-dimethylsilane
CID 87683108

Frequently Asked Questions

What is the IUPAC name of 11-bromoundecyl-dibutyl-methylsilane?
The IUPAC name of 11-bromoundecyl-dibutyl-methylsilane (CID 162391784) is 11-bromoundecyl-dibutyl-methylsilane.
What is the SMILES notation for 11-bromoundecyl-dibutyl-methylsilane?
The canonical SMILES for 11-bromoundecyl-dibutyl-methylsilane is CCCC[Si](C)(CCCC)CCCCCCCCCCCBr.
What is the InChIKey of 11-bromoundecyl-dibutyl-methylsilane?
The InChIKey is QUXBHNZLKXKLQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H43BrSi/c1-4-6-18-22(3,19-7-5-2)20-16-14-12-10-8-9-11-13-15-17-21/h4-20H2,1-3H3.
What are the key properties of 11-bromoundecyl-dibutyl-methylsilane?
11-bromoundecyl-dibutyl-methylsilane has a molecular weight of 391.55 g/mol, XLogP of 8.57, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11-bromoundecyl-dibutyl-methylsilane is sourced from PubChem (CID 162391784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).