2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one

C14H30O2Si — CID 72740805

IUPAC2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one
SMILESCCCCCCC(=O)C(C)[Si](C)(C)OC(C)C
InChIInChI=1S/C14H30O2Si/c1-7-8-9-10-11-14(15)13(4)17(5,6)16-12(2)3/h12-13H,7-11H2,1-6H3
InChIKeyMFNLLXGQNHCBAL-UHFFFAOYSA-N
MW258.48 g/mol
LogP4.55
Rot. Bonds9

About 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one

2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one (PubChem CID 72740805) has the molecular formula C14H30O2Si and a molecular weight of 258.48 g/mol. Its IUPAC name is 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one.

Molecular Properties

Compound Name2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one
PubChem CID72740805
Molecular FormulaC14H30O2Si
Molecular Weight258.48 g/mol
Exact Mass258.20
IUPAC Name2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one
SMILESCCCCCCC(=O)C(C)[Si](C)(C)OC(C)C
InChIInChI=1S/C14H30O2Si/c1-7-8-9-10-11-14(15)13(4)17(5,6)16-12(2)3/h12-13H,7-11H2,1-6H3
InChIKeyMFNLLXGQNHCBAL-UHFFFAOYSA-N
XLogP4.55
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.48
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[Tert-butyl(dimethyl)silyl]oxyoctan-2-one
CID 88003235
1,1-Dimethylsilacyclotridecan-7-one
CID 554403
4-[Tert-butyl(dimethyl)silyl]peroxyoctan-2-one
CID 10612403
5-(Trimethylsilyl)decan-4-one
CID 12524698
3-Trimethylsilyloctan-2-one
CID 12524711
1-Trimethylsilylundecan-3-one
CID 13225586
1-Trimethylsilylundecan-2-one
CID 13737766
3-[Dimethyl(propan-2-yloxy)silyl]heptan-4-one
CID 72740800
5-[Dimethyl(propan-2-yloxy)silyl]undecan-4-one
CID 134889798
2-[Dimethyl(propan-2-yloxy)silyl]hexan-3-one
CID 134890058
1-Trimethylsilyldodecane-2,5-dione
CID 134987671
(4R)-4-trimethylsilyloxyoctan-2-one
CID 135036825

Frequently Asked Questions

What is the IUPAC name of 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one?
The IUPAC name of 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one (CID 72740805) is 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one.
What is the SMILES notation for 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one?
The canonical SMILES for 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one is CCCCCCC(=O)C(C)[Si](C)(C)OC(C)C.
What is the InChIKey of 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one?
The InChIKey is MFNLLXGQNHCBAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O2Si/c1-7-8-9-10-11-14(15)13(4)17(5,6)16-12(2)3/h12-13H,7-11H2,1-6H3.
What are the key properties of 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one?
2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one has a molecular weight of 258.48 g/mol, XLogP of 4.55, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dimethyl(propan-2-yloxy)silyl]nonan-3-one is sourced from PubChem (CID 72740805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).