ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one

C12H30OSi2 — CID 161255717

IUPACethyl(dimethyl)silane;1-trimethylsilylpentan-3-one
SMILESCCC(=O)CC[Si](C)(C)C.CC[SiH](C)C
InChIInChI=1S/C8H18OSi.C4H12Si/c1-5-8(9)6-7-10(2,3)4;1-4-5(2)3/h5-7H2,1-4H3;5H,4H2,1-3H3
InChIKeyVBWQTJHCXIKNMT-UHFFFAOYSA-N
MW246.54 g/mol
LogP4.19
Rot. Bonds5

About ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one

ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one (PubChem CID 161255717) has the molecular formula C12H30OSi2 and a molecular weight of 246.54 g/mol. Its IUPAC name is ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one.

Molecular Properties

Compound Nameethyl(dimethyl)silane;1-trimethylsilylpentan-3-one
PubChem CID161255717
Molecular FormulaC12H30OSi2
Molecular Weight246.54 g/mol
Exact Mass246.18
IUPAC Nameethyl(dimethyl)silane;1-trimethylsilylpentan-3-one
SMILESCCC(=O)CC[Si](C)(C)C.CC[SiH](C)C
InChIInChI=1S/C8H18OSi.C4H12Si/c1-5-8(9)6-7-10(2,3)4;1-4-5(2)3/h5-7H2,1-4H3;5H,4H2,1-3H3
InChIKeyVBWQTJHCXIKNMT-UHFFFAOYSA-N
XLogP4.19
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.54
LogP ≤ 54.19
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 ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one?
The IUPAC name of ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one (CID 161255717) is ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one.
What is the SMILES notation for ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one?
The canonical SMILES for ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one is CCC(=O)CC[Si](C)(C)C.CC[SiH](C)C.
What is the InChIKey of ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one?
The InChIKey is VBWQTJHCXIKNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18OSi.C4H12Si/c1-5-8(9)6-7-10(2,3)4;1-4-5(2)3/h5-7H2,1-4H3;5H,4H2,1-3H3.
What are the key properties of ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one?
ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one has a molecular weight of 246.54 g/mol, XLogP of 4.19, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(dimethyl)silane;1-trimethylsilylpentan-3-one is sourced from PubChem (CID 161255717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).