alumane;butane;ethoxy(phenyl)silane

C12H25AlOSi — CID 173424285

IUPACalumane;butane;ethoxy(phenyl)silane
SMILESCCCC.CCO[SiH2]c1ccccc1.[AlH3]
InChIInChI=1S/C8H12OSi.C4H10.Al.3H/c1-2-9-10-8-6-4-3-5-7-8;1-3-4-2;;;;/h3-7H,2,10H2,1H3;3-4H2,1-2H3;;;;
InChIKeyWWKIZLMHQIOTNE-UHFFFAOYSA-N
MW240.40 g/mol
LogP1.05
Rot. Bonds4

About alumane;butane;ethoxy(phenyl)silane

alumane;butane;ethoxy(phenyl)silane (PubChem CID 173424285) has the molecular formula C12H25AlOSi and a molecular weight of 240.40 g/mol. Its IUPAC name is alumane;butane;ethoxy(phenyl)silane.

Molecular Properties

Compound Namealumane;butane;ethoxy(phenyl)silane
PubChem CID173424285
Molecular FormulaC12H25AlOSi
Molecular Weight240.40 g/mol
Exact Mass240.15
IUPAC Namealumane;butane;ethoxy(phenyl)silane
SMILESCCCC.CCO[SiH2]c1ccccc1.[AlH3]
InChIInChI=1S/C8H12OSi.C4H10.Al.3H/c1-2-9-10-8-6-4-3-5-7-8;1-3-4-2;;;;/h3-7H,2,10H2,1H3;3-4H2,1-2H3;;;;
InChIKeyWWKIZLMHQIOTNE-UHFFFAOYSA-N
XLogP1.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.40
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of alumane;butane;ethoxy(phenyl)silane?
The IUPAC name of alumane;butane;ethoxy(phenyl)silane (CID 173424285) is alumane;butane;ethoxy(phenyl)silane.
What is the SMILES notation for alumane;butane;ethoxy(phenyl)silane?
The canonical SMILES for alumane;butane;ethoxy(phenyl)silane is CCCC.CCO[SiH2]c1ccccc1.[AlH3].
What is the InChIKey of alumane;butane;ethoxy(phenyl)silane?
The InChIKey is WWKIZLMHQIOTNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12OSi.C4H10.Al.3H/c1-2-9-10-8-6-4-3-5-7-8;1-3-4-2;;;;/h3-7H,2,10H2,1H3;3-4H2,1-2H3;;;;.
What are the key properties of alumane;butane;ethoxy(phenyl)silane?
alumane;butane;ethoxy(phenyl)silane has a molecular weight of 240.40 g/mol, XLogP of 1.05, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;butane;ethoxy(phenyl)silane is sourced from PubChem (CID 173424285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).