1,5-bis(trimethylsilyl)pentan-3-one

C11H26OSi2 — CID 11481640

IUPAC1,5-bis(trimethylsilyl)pentan-3-one
SMILESC[Si](C)(C)CCC(=O)CC[Si](C)(C)C
InChIInChI=1S/C11H26OSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h7-10H2,1-6H3
InChIKeyOQVPXZQYWKRFHQ-UHFFFAOYSA-N
MW230.50 g/mol
LogP4.01
Rot. Bonds6

About 1,5-bis(trimethylsilyl)pentan-3-one

1,5-bis(trimethylsilyl)pentan-3-one (PubChem CID 11481640) has the molecular formula C11H26OSi2 and a molecular weight of 230.50 g/mol. Its IUPAC name is 1,5-bis(trimethylsilyl)pentan-3-one.

Molecular Properties

Compound Name1,5-bis(trimethylsilyl)pentan-3-one
PubChem CID11481640
Molecular FormulaC11H26OSi2
Molecular Weight230.50 g/mol
Exact Mass230.15
IUPAC Name1,5-bis(trimethylsilyl)pentan-3-one
SMILESC[Si](C)(C)CCC(=O)CC[Si](C)(C)C
InChIInChI=1S/C11H26OSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h7-10H2,1-6H3
InChIKeyOQVPXZQYWKRFHQ-UHFFFAOYSA-N
XLogP4.01
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.50
LogP ≤ 54.01
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 1,5-bis(trimethylsilyl)pentan-3-one?
The IUPAC name of 1,5-bis(trimethylsilyl)pentan-3-one (CID 11481640) is 1,5-bis(trimethylsilyl)pentan-3-one.
What is the SMILES notation for 1,5-bis(trimethylsilyl)pentan-3-one?
The canonical SMILES for 1,5-bis(trimethylsilyl)pentan-3-one is C[Si](C)(C)CCC(=O)CC[Si](C)(C)C.
What is the InChIKey of 1,5-bis(trimethylsilyl)pentan-3-one?
The InChIKey is OQVPXZQYWKRFHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26OSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h7-10H2,1-6H3.
What are the key properties of 1,5-bis(trimethylsilyl)pentan-3-one?
1,5-bis(trimethylsilyl)pentan-3-one has a molecular weight of 230.50 g/mol, XLogP of 4.01, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-bis(trimethylsilyl)pentan-3-one is sourced from PubChem (CID 11481640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).