dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane

C20H44Cl2Si2 — CID 87144873

IUPACdibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane
SMILESCCCC[Si](Cl)(CCCC)CCCC[Si](Cl)(CCCC)CCCC
InChIInChI=1S/C20H44Cl2Si2/c1-5-9-15-23(21,16-10-6-2)19-13-14-20-24(22,17-11-7-3)18-12-8-4/h5-20H2,1-4H3
InChIKeyMMEKAAYRFPCVJN-UHFFFAOYSA-N
MW411.65 g/mol
LogP9.34
Rot. Bonds17

About dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane

dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane (PubChem CID 87144873) has the molecular formula C20H44Cl2Si2 and a molecular weight of 411.65 g/mol. Its IUPAC name is dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane.

Molecular Properties

Compound Namedibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane
PubChem CID87144873
Molecular FormulaC20H44Cl2Si2
Molecular Weight411.65 g/mol
Exact Mass410.24
IUPAC Namedibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane
SMILESCCCC[Si](Cl)(CCCC)CCCC[Si](Cl)(CCCC)CCCC
InChIInChI=1S/C20H44Cl2Si2/c1-5-9-15-23(21,16-10-6-2)19-13-14-20-24(22,17-11-7-3)18-12-8-4/h5-20H2,1-4H3
InChIKeyMMEKAAYRFPCVJN-UHFFFAOYSA-N
XLogP9.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.65
LogP ≤ 59.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 21354
butyl-[2-(butyl-chloro-decylsilyl)ethynyl]-chloro-decylsilane
CID 139634038
chloro-dimethyl-nonadecylsilane
CID 87338427
dibutyl-chloro-[chloro(dimethyl)silyl]silane
CID 71420046
chloro-hex-5-enyl-oct-7-enyl-propylsilane
CID 151435070
N-(butyl-chloro-propan-2-ylsilyl)methanamine
CID 87335233
dichloro-[6-[dichloro-[6-[dichloro-[6-[dichloro-[6-[dichloro(heptyl)silyl]hexyl]silyl]hexyl]silyl]hexyl]silyl]hexyl]-propylsilane
CID 59426953
1-[[(butyl-chloro-methylsilyl)amino]-chloro-methylsilyl]butane
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Frequently Asked Questions

What is the IUPAC name of dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane?
The IUPAC name of dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane (CID 87144873) is dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane.
What is the SMILES notation for dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane?
The canonical SMILES for dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane is CCCC[Si](Cl)(CCCC)CCCC[Si](Cl)(CCCC)CCCC.
What is the InChIKey of dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane?
The InChIKey is MMEKAAYRFPCVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H44Cl2Si2/c1-5-9-15-23(21,16-10-6-2)19-13-14-20-24(22,17-11-7-3)18-12-8-4/h5-20H2,1-4H3.
What are the key properties of dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane?
dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane has a molecular weight of 411.65 g/mol, XLogP of 9.34, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane is sourced from PubChem (CID 87144873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).