2-methyl-2-propan-2-yloxy-1-silylbutan-1-one

C8H18O2Si — CID 173236358

IUPAC2-methyl-2-propan-2-yloxy-1-silylbutan-1-one
SMILESCCC(C)(OC(C)C)C(=O)[SiH3]
InChIInChI=1S/C8H18O2Si/c1-5-8(4,7(9)11)10-6(2)3/h6H,5H2,1-4,11H3
InChIKeyCVZPPRWFCHHZFA-UHFFFAOYSA-N
MW174.32 g/mol
LogP0.47
Rot. Bonds4

About 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one

2-methyl-2-propan-2-yloxy-1-silylbutan-1-one (PubChem CID 173236358) has the molecular formula C8H18O2Si and a molecular weight of 174.32 g/mol. Its IUPAC name is 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one.

Molecular Properties

Compound Name2-methyl-2-propan-2-yloxy-1-silylbutan-1-one
PubChem CID173236358
Molecular FormulaC8H18O2Si
Molecular Weight174.32 g/mol
Exact Mass174.11
IUPAC Name2-methyl-2-propan-2-yloxy-1-silylbutan-1-one
SMILESCCC(C)(OC(C)C)C(=O)[SiH3]
InChIInChI=1S/C8H18O2Si/c1-5-8(4,7(9)11)10-6(2)3/h6H,5H2,1-4,11H3
InChIKeyCVZPPRWFCHHZFA-UHFFFAOYSA-N
XLogP0.47
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.32
LogP ≤ 50.47
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

2-methyl-2-(4-methylpentan-2-yloxy)butanoic acid
CID 114987810
alumane;2,2-di(propan-2-yloxy)butanoic acid
CID 174388834
3-methyl-3-propan-2-yloxypentan-1-ol
CID 123376010
propan-2-yl (2R)-2-cyanato-2-methylbutanoate
CID 118967910
3-ethoxy-3,5-dimethylheptan-4-one
CID 116746837
propyl 2-methyl-2-propan-2-yloxypropanoate
CID 174484863
3-ethylpentan-3-yl propan-2-yl carbonate
CID 173147258
4-ethyl-4-methyl-2-(3-methylpentan-3-yloxy)hexan-3-one
CID 89030369
propan-2-yl 2-ethyl-2,3-dimethylbutanoate
CID 87568455
aluminum tris(4-ethyl-3-oxo-4-propan-2-yloxyhexanoate)
CID 160863535
2-methyl-3-phenyl-2-propan-2-yloxypropanamide
CID 142432674
3-methylpentan-3-yl 2-methylpropanoate
CID 59491986

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one?
The IUPAC name of 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one (CID 173236358) is 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one.
What is the SMILES notation for 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one?
The canonical SMILES for 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one is CCC(C)(OC(C)C)C(=O)[SiH3].
What is the InChIKey of 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one?
The InChIKey is CVZPPRWFCHHZFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2Si/c1-5-8(4,7(9)11)10-6(2)3/h6H,5H2,1-4,11H3.
What are the key properties of 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one?
2-methyl-2-propan-2-yloxy-1-silylbutan-1-one has a molecular weight of 174.32 g/mol, XLogP of 0.47, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-propan-2-yloxy-1-silylbutan-1-one is sourced from PubChem (CID 173236358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).