butoxy-butyl-methyl-nonan-5-ylsilane

C18H40OSi — CID 141433709

IUPACbutoxy-butyl-methyl-nonan-5-ylsilane
SMILESCCCCO[Si](C)(CCCC)C(CCCC)CCCC
InChIInChI=1S/C18H40OSi/c1-6-10-14-18(15-11-7-2)20(5,17-13-9-4)19-16-12-8-3/h18H,6-17H2,1-5H3
InChIKeyHFDNCVNDJHIFGS-UHFFFAOYSA-N
MW300.60 g/mol
LogP6.93
Rot. Bonds14

About butoxy-butyl-methyl-nonan-5-ylsilane

butoxy-butyl-methyl-nonan-5-ylsilane (PubChem CID 141433709) has the molecular formula C18H40OSi and a molecular weight of 300.60 g/mol. Its IUPAC name is butoxy-butyl-methyl-nonan-5-ylsilane.

Molecular Properties

Compound Namebutoxy-butyl-methyl-nonan-5-ylsilane
PubChem CID141433709
Molecular FormulaC18H40OSi
Molecular Weight300.60 g/mol
Exact Mass300.28
IUPAC Namebutoxy-butyl-methyl-nonan-5-ylsilane
SMILESCCCCO[Si](C)(CCCC)C(CCCC)CCCC
InChIInChI=1S/C18H40OSi/c1-6-10-14-18(15-11-7-2)20(5,17-13-9-4)19-16-12-8-3/h18H,6-17H2,1-5H3
InChIKeyHFDNCVNDJHIFGS-UHFFFAOYSA-N
XLogP6.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.60
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

butoxy(tributyl)silane
CID 594608
dibutoxy-[4-[dibutoxy(methyl)silyl]butyl]-methylsilane
CID 87144867
butoxy-dibutyl-ethylsilane
CID 141095554
butoxy-iodo-dimethylsilane
CID 88777497
tributoxy(1-butoxybutyl)silane
CID 54422613
butoxy-butyl-dimethoxysilane
CID 139714527
butyl-dimethyl-octoxysilane
CID 604386
dibutoxy-methyl-octylsilane
CID 54173263
butoxy-dimethyl-pentan-2-yloxysilane
CID 91726705
butoxy-dimethyl-propylsilane;butyl-hydroxy-dimethylsilane
CID 174694478
tributyl(2-ethylhexoxy)silane
CID 623167
dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane
CID 87144336

Frequently Asked Questions

What is the IUPAC name of butoxy-butyl-methyl-nonan-5-ylsilane?
The IUPAC name of butoxy-butyl-methyl-nonan-5-ylsilane (CID 141433709) is butoxy-butyl-methyl-nonan-5-ylsilane.
What is the SMILES notation for butoxy-butyl-methyl-nonan-5-ylsilane?
The canonical SMILES for butoxy-butyl-methyl-nonan-5-ylsilane is CCCCO[Si](C)(CCCC)C(CCCC)CCCC.
What is the InChIKey of butoxy-butyl-methyl-nonan-5-ylsilane?
The InChIKey is HFDNCVNDJHIFGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40OSi/c1-6-10-14-18(15-11-7-2)20(5,17-13-9-4)19-16-12-8-3/h18H,6-17H2,1-5H3.
What are the key properties of butoxy-butyl-methyl-nonan-5-ylsilane?
butoxy-butyl-methyl-nonan-5-ylsilane has a molecular weight of 300.60 g/mol, XLogP of 6.93, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-butyl-methyl-nonan-5-ylsilane is sourced from PubChem (CID 141433709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).