dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane

C26H58O4Si2 — CID 87144336

IUPACdibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane
SMILESCCCCO[Si](CCCC[Si](OCCCC)(OCCCC)C(C)C)(OCCCC)C(C)C
InChIInChI=1S/C26H58O4Si2/c1-9-13-19-27-31(25(5)6,28-20-14-10-2)23-17-18-24-32(26(7)8,29-21-15-11-3)30-22-16-12-4/h25-26H,9-24H2,1-8H3
InChIKeyWBNHRTVULCPUKB-UHFFFAOYSA-N
MW490.92 g/mol
LogP8.74
Rot. Bonds23

About dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane

dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane (PubChem CID 87144336) has the molecular formula C26H58O4Si2 and a molecular weight of 490.92 g/mol. Its IUPAC name is dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane.

Molecular Properties

Compound Namedibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane
PubChem CID87144336
Molecular FormulaC26H58O4Si2
Molecular Weight490.92 g/mol
Exact Mass490.39
IUPAC Namedibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane
SMILESCCCCO[Si](CCCC[Si](OCCCC)(OCCCC)C(C)C)(OCCCC)C(C)C
InChIInChI=1S/C26H58O4Si2/c1-9-13-19-27-31(25(5)6,28-20-14-10-2)23-17-18-24-32(26(7)8,29-21-15-11-3)30-22-16-12-4/h25-26H,9-24H2,1-8H3
InChIKeyWBNHRTVULCPUKB-UHFFFAOYSA-N
XLogP8.74
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds23
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500490.92
LogP ≤ 58.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane
CID 87143863
dibutoxy-di(propan-2-yl)silane
CID 14324874
dibutoxy-[4-[dibutoxy(methyl)silyl]butyl]-methylsilane
CID 87144867
butoxy(tributyl)silane
CID 594608
3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane
CID 141219255
dibutoxy-methyl-octylsilane
CID 54173263
butoxy-dimethyl-pentan-2-yloxysilane
CID 91726705
butan-2-yl-butyl-diethoxysilane
CID 23358225
4-[butyl(dipropoxy)silyl]pentan-1-amine
CID 88812128
butoxy-ethoxy-dioctylsilane
CID 89350080
dibutoxy-ethyl-(2-methylpropyl)silane
CID 87899678
tributoxy(4-chlorobutyl)silane
CID 141455005

Frequently Asked Questions

What is the IUPAC name of dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane?
The IUPAC name of dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane (CID 87144336) is dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane.
What is the SMILES notation for dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane?
The canonical SMILES for dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane is CCCCO[Si](CCCC[Si](OCCCC)(OCCCC)C(C)C)(OCCCC)C(C)C.
What is the InChIKey of dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane?
The InChIKey is WBNHRTVULCPUKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H58O4Si2/c1-9-13-19-27-31(25(5)6,28-20-14-10-2)23-17-18-24-32(26(7)8,29-21-15-11-3)30-22-16-12-4/h25-26H,9-24H2,1-8H3.
What are the key properties of dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane?
dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane has a molecular weight of 490.92 g/mol, XLogP of 8.74, 23 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane is sourced from PubChem (CID 87144336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).