3-[dimethyl(propan-2-yloxy)silyl]decan-4-one

C15H32O2Si — CID 135049385

IUPAC3-[dimethyl(propan-2-yloxy)silyl]decan-4-one
SMILESCCCCCCC(=O)C(CC)[Si](C)(C)OC(C)C
InChIInChI=1S/C15H32O2Si/c1-7-9-10-11-12-14(16)15(8-2)18(5,6)17-13(3)4/h13,15H,7-12H2,1-6H3
InChIKeyMRNNWRNNXHBIBA-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.94
Rot. Bonds10

About 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one

3-[dimethyl(propan-2-yloxy)silyl]decan-4-one (PubChem CID 135049385) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one.

Molecular Properties

Compound Name3-[dimethyl(propan-2-yloxy)silyl]decan-4-one
PubChem CID135049385
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name3-[dimethyl(propan-2-yloxy)silyl]decan-4-one
SMILESCCCCCCC(=O)C(CC)[Si](C)(C)OC(C)C
InChIInChI=1S/C15H32O2Si/c1-7-9-10-11-12-14(16)15(8-2)18(5,6)17-13(3)4/h13,15H,7-12H2,1-6H3
InChIKeyMRNNWRNNXHBIBA-UHFFFAOYSA-N
XLogP4.94
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.94
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

1-[Tert-butyl(dimethyl)silyl]oxyundec-2-yn-4-one
CID 88867921
7-(Trimethylsilyl)dodecan-6-one
CID 13048500
3-[Dimethyl(propan-2-yloxy)silyl]heptan-4-one
CID 72740800
2-[Dimethyl(propan-2-yloxy)silyl]nonan-3-one
CID 72740805
16-Triethylsilyloxyhexadecan-2-one
CID 86010278
5-[Dimethyl(propan-2-yloxy)silyl]undecan-4-one
CID 134889798
(4R)-4-trimethylsilyloxyoctan-2-one
CID 135036825
3-[Dimethyl(propan-2-yloxy)silyl]nonan-2-one
CID 135049549
8-[Dimethyl(propan-2-yloxy)silyl]tetradecan-7-one
CID 135049559
4-[Tert-butyl(dimethyl)silyl]oxyoctan-2-one
CID 135080486
1,17-Bis(trimethylsilyl)heptadecane-3,15-dione
CID 139254511
3-[Bis[[dimethyl(trimethylsilyloxy)silyl]oxy]-methylsilyl]dodecan-2-one
CID 20750492

Frequently Asked Questions

What is the IUPAC name of 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one?
The IUPAC name of 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one (CID 135049385) is 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one.
What is the SMILES notation for 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one?
The canonical SMILES for 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one is CCCCCCC(=O)C(CC)[Si](C)(C)OC(C)C.
What is the InChIKey of 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one?
The InChIKey is MRNNWRNNXHBIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-7-9-10-11-12-14(16)15(8-2)18(5,6)17-13(3)4/h13,15H,7-12H2,1-6H3.
What are the key properties of 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one?
3-[dimethyl(propan-2-yloxy)silyl]decan-4-one has a molecular weight of 272.50 g/mol, XLogP of 4.94, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethyl(propan-2-yloxy)silyl]decan-4-one is sourced from PubChem (CID 135049385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).