Silane-acetone

C3H6OSi — CID 18680436

IUPAC—
SMILESCC(C)=O.[Si]
InChIInChI=1S/C3H6O.Si/c1-3(2)4;/h1-2H3;
InChIKeyBHCIEQZOSOEXOJ-UHFFFAOYSA-N
MW86.17 g/mol
LogP0.21
Rot. Bonds

About Silane-acetone

Silane-acetone (PubChem CID 18680436) has the molecular formula C3H6OSi and a molecular weight of 86.17 g/mol.

Molecular Properties

Compound NameSilane-acetone
PubChem CID18680436
Molecular FormulaC3H6OSi
Molecular Weight86.17 g/mol
Exact Mass86.02
IUPAC Name—
SMILESCC(C)=O.[Si]
InChIInChI=1S/C3H6O.Si/c1-3(2)4;/h1-2H3;
InChIKeyBHCIEQZOSOEXOJ-UHFFFAOYSA-N
XLogP0.21
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.17
LogP ≤ 50.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 71340648
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methanol;propan-2-one;hydrate
CID 86590524
propan-2-one;sulfur monoxide
CID 21387950
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CID 173410195
propane;propan-2-one
CID 90822370
sodium;alumane;hydride;propan-2-one
CID 175242051
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CID 174901322

Frequently Asked Questions

What is the IUPAC name of Silane-acetone?
The IUPAC name of Silane-acetone (CID 18680436) is not available.
What is the SMILES notation for Silane-acetone?
The canonical SMILES for Silane-acetone is CC(C)=O.[Si].
What is the InChIKey of Silane-acetone?
The InChIKey is BHCIEQZOSOEXOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O.Si/c1-3(2)4;/h1-2H3;.
What are the key properties of Silane-acetone?
Silane-acetone has a molecular weight of 86.17 g/mol, XLogP of 0.21, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Silane-acetone is sourced from PubChem (CID 18680436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).