3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one

C11H22O2Si — CID 173464738

IUPAC3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one
SMILESC[SiH](C)OC(C1CC(=O)C1)C(C)(C)C
InChIInChI=1S/C11H22O2Si/c1-11(2,3)10(13-14(4)5)8-6-9(12)7-8/h8,10,14H,6-7H2,1-5H3
InChIKeyICFHUGMWZNUYHO-UHFFFAOYSA-N
MW214.38 g/mol
LogP2.38
Rot. Bonds3

About 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one

3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one (PubChem CID 173464738) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one.

Molecular Properties

Compound Name3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one
PubChem CID173464738
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one
SMILESC[SiH](C)OC(C1CC(=O)C1)C(C)(C)C
InChIInChI=1S/C11H22O2Si/c1-11(2,3)10(13-14(4)5)8-6-9(12)7-8/h8,10,14H,6-7H2,1-5H3
InChIKeyICFHUGMWZNUYHO-UHFFFAOYSA-N
XLogP2.38
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 52.38
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-(1-dimethylsilyloxy-2,2-dimethylpropyl)oxan-4-one
CID 173174133
prop-2-enyl (2S)-2-(1-dimethylsilyloxy-2,2-dimethylpropyl)-4-oxopyrrolidine-1-carboxylate
CID 173171481
(3aR,4R,5R,6aS)-4-(1-dimethylsilyloxy-2,2-dimethylpropyl)-5-hydroxy-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one
CID 173302315
6-(1-dimethylsilyloxy-2,2-dimethylpropyl)bicyclo[3.1.0]hexan-2-ol
CID 173134931
tert-butyl (3S,4S)-3-(1-dimethylsilyloxy-2,2-dimethylpropyl)-4-formylpyrrolidine-1-carboxylate
CID 173083476
(1-cyclobutyl-2,2-dimethylpropoxy)-diphenylsilane
CID 173387668
5-(dimethoxymethyl)cyclohexane-1,3-dione
CID 19347799
3-[(1R)-1-(methylamino)ethyl]cyclobutan-1-one
CID 129495426
4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine
CID 173121594
CID 18616635
CID 18616635
tert-butyl N-[(1S,2S,4R)-2-amino-4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexyl]carbamate
CID 173121597
[3,3-dimethyl-1-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]butan-2-yl]oxy-dimethylsilane
CID 173329753

Frequently Asked Questions

What is the IUPAC name of 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one?
The IUPAC name of 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one (CID 173464738) is 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one.
What is the SMILES notation for 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one?
The canonical SMILES for 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one is C[SiH](C)OC(C1CC(=O)C1)C(C)(C)C.
What is the InChIKey of 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one?
The InChIKey is ICFHUGMWZNUYHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-11(2,3)10(13-14(4)5)8-6-9(12)7-8/h8,10,14H,6-7H2,1-5H3.
What are the key properties of 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one?
3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one has a molecular weight of 214.38 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-dimethylsilyloxy-2,2-dimethylpropyl)cyclobutan-1-one is sourced from PubChem (CID 173464738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).