2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione

C12H26O2Si2 — CID 15877499

IUPAC2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione
SMILESCC(CCC(=O)[Si](C)(C)C)C(=O)[Si](C)(C)C
InChIInChI=1S/C12H26O2Si2/c1-10(12(14)16(5,6)7)8-9-11(13)15(2,3)4/h10H,8-9H2,1-7H3
InChIKeyFJMXDWPIDNJUOC-UHFFFAOYSA-N
MW258.51 g/mol
LogP3.30
Rot. Bonds6

About 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione

2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione (PubChem CID 15877499) has the molecular formula C12H26O2Si2 and a molecular weight of 258.51 g/mol. Its IUPAC name is 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione.

Molecular Properties

Compound Name2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione
PubChem CID15877499
Molecular FormulaC12H26O2Si2
Molecular Weight258.51 g/mol
Exact Mass258.15
IUPAC Name2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione
SMILESCC(CCC(=O)[Si](C)(C)C)C(=O)[Si](C)(C)C
InChIInChI=1S/C12H26O2Si2/c1-10(12(14)16(5,6)7)8-9-11(13)15(2,3)4/h10H,8-9H2,1-7H3
InChIKeyFJMXDWPIDNJUOC-UHFFFAOYSA-N
XLogP3.30
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.51
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,5-Bis(trimethylsilyl)pentane-1,5-dione
CID 10705494
Silane, (1,5-dioxo-1,5-pentanediyl)bis[(1,1-dimethylethyl)dimethyl-
CID 11198255
4-Methyl-1-trimethylsilylpentan-1-one
CID 12529248
1,5-Bis[tert-butyl(dimethyl)silyl]-2-methylpentane-1,5-dione
CID 15877500
1-[Tert-butyl(dimethyl)silyl]-5-triethylsilylpentane-1,5-dione
CID 15877501
1,1,3-Trimethylsilinan-2-one
CID 71332283
4-Methyl-1-trimethylsilylpentane-1,3-dione
CID 18710582
1-[Dimethyl(4-methylpentanoyl)silyl]-4-methylpentan-1-one
CID 154204019
Methane;4-methyl-1-trimethylsilylpentane-1,3-dione
CID 158299529
1-[Dimethyl(3-methylpentanoyl)silyl]-3-methylpentan-1-one
CID 163544897
2-Methyl-1,6-bis(trimethylsilyl)hexane-1,6-dione
CID 10516350
2,5-Dimethyl-1,6-bis(trimethylsilyl)hexane-1,6-dione
CID 10660910

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione?
The IUPAC name of 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione (CID 15877499) is 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione.
What is the SMILES notation for 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione?
The canonical SMILES for 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione is CC(CCC(=O)[Si](C)(C)C)C(=O)[Si](C)(C)C.
What is the InChIKey of 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione?
The InChIKey is FJMXDWPIDNJUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si2/c1-10(12(14)16(5,6)7)8-9-11(13)15(2,3)4/h10H,8-9H2,1-7H3.
What are the key properties of 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione?
2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione has a molecular weight of 258.51 g/mol, XLogP of 3.30, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,5-bis(trimethylsilyl)pentane-1,5-dione is sourced from PubChem (CID 15877499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).