butan-2-yl-butyl-diethoxysilane

C12H28O2Si — CID 23358225

IUPACbutan-2-yl-butyl-diethoxysilane
SMILESCCCC[Si](OCC)(OCC)C(C)CC
InChIInChI=1S/C12H28O2Si/c1-6-10-11-15(13-8-3,14-9-4)12(5)7-2/h12H,6-11H2,1-5H3
InChIKeyYIZVHIYQHHDAGJ-UHFFFAOYSA-N
MW232.44 g/mol
LogP4.10
Rot. Bonds9

About butan-2-yl-butyl-diethoxysilane

butan-2-yl-butyl-diethoxysilane (PubChem CID 23358225) has the molecular formula C12H28O2Si and a molecular weight of 232.44 g/mol. Its IUPAC name is butan-2-yl-butyl-diethoxysilane.

Molecular Properties

Compound Namebutan-2-yl-butyl-diethoxysilane
PubChem CID23358225
Molecular FormulaC12H28O2Si
Molecular Weight232.44 g/mol
Exact Mass232.19
IUPAC Namebutan-2-yl-butyl-diethoxysilane
SMILESCCCC[Si](OCC)(OCC)C(C)CC
InChIInChI=1S/C12H28O2Si/c1-6-10-11-15(13-8-3,14-9-4)12(5)7-2/h12H,6-11H2,1-5H3
InChIKeyYIZVHIYQHHDAGJ-UHFFFAOYSA-N
XLogP4.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.44
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane
CID 172844126
4-[butyl(dipropoxy)silyl]pentan-1-amine
CID 88812128
butan-2-yl-dimethoxy-propylsilane
CID 22616756
N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 87635244
1-[diethoxy(propyl)silyl]propan-1-amine
CID 87427191
dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane
CID 87144336
dibromo-butyl-ethoxysilane
CID 140745096
butyl-diethoxy-iodosilane
CID 154487050
bromo-butan-2-yl-diethoxysilane
CID 175042762
diethoxy-hept-5-en-2-yl-propylsilane
CID 150905380
1-[diethoxy(ethyl)silyl]ethyl-diethoxy-ethylsilane
CID 87295758
butyl-diethoxy-tetradecylsilane
CID 139614088

Frequently Asked Questions

What is the IUPAC name of butan-2-yl-butyl-diethoxysilane?
The IUPAC name of butan-2-yl-butyl-diethoxysilane (CID 23358225) is butan-2-yl-butyl-diethoxysilane.
What is the SMILES notation for butan-2-yl-butyl-diethoxysilane?
The canonical SMILES for butan-2-yl-butyl-diethoxysilane is CCCC[Si](OCC)(OCC)C(C)CC.
What is the InChIKey of butan-2-yl-butyl-diethoxysilane?
The InChIKey is YIZVHIYQHHDAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O2Si/c1-6-10-11-15(13-8-3,14-9-4)12(5)7-2/h12H,6-11H2,1-5H3.
What are the key properties of butan-2-yl-butyl-diethoxysilane?
butan-2-yl-butyl-diethoxysilane has a molecular weight of 232.44 g/mol, XLogP of 4.10, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yl-butyl-diethoxysilane is sourced from PubChem (CID 23358225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).