methane;4-methyl-1-trimethylsilylpentane-1,3-dione

C10H22O2Si — CID 158299529

IUPACmethane;4-methyl-1-trimethylsilylpentane-1,3-dione
SMILESC.CC(C)C(=O)CC(=O)[Si](C)(C)C
InChIInChI=1S/C9H18O2Si.CH4/c1-7(2)8(10)6-9(11)12(3,4)5;/h7H,6H2,1-5H3;1H4
InChIKeyGMIGKLWWBFLRRC-UHFFFAOYSA-N
MW202.37 g/mol
LogP2.68
Rot. Bonds4

About methane;4-methyl-1-trimethylsilylpentane-1,3-dione

methane;4-methyl-1-trimethylsilylpentane-1,3-dione (PubChem CID 158299529) has the molecular formula C10H22O2Si and a molecular weight of 202.37 g/mol. Its IUPAC name is methane;4-methyl-1-trimethylsilylpentane-1,3-dione.

Molecular Properties

Compound Namemethane;4-methyl-1-trimethylsilylpentane-1,3-dione
PubChem CID158299529
Molecular FormulaC10H22O2Si
Molecular Weight202.37 g/mol
Exact Mass202.14
IUPAC Namemethane;4-methyl-1-trimethylsilylpentane-1,3-dione
SMILESC.CC(C)C(=O)CC(=O)[Si](C)(C)C
InChIInChI=1S/C9H18O2Si.CH4/c1-7(2)8(10)6-9(11)12(3,4)5;/h7H,6H2,1-5H3;1H4
InChIKeyGMIGKLWWBFLRRC-UHFFFAOYSA-N
XLogP2.68
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.37
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methane;4-methyl-1-trimethylsilylpentane-1,3-dione?
The IUPAC name of methane;4-methyl-1-trimethylsilylpentane-1,3-dione (CID 158299529) is methane;4-methyl-1-trimethylsilylpentane-1,3-dione.
What is the SMILES notation for methane;4-methyl-1-trimethylsilylpentane-1,3-dione?
The canonical SMILES for methane;4-methyl-1-trimethylsilylpentane-1,3-dione is C.CC(C)C(=O)CC(=O)[Si](C)(C)C.
What is the InChIKey of methane;4-methyl-1-trimethylsilylpentane-1,3-dione?
The InChIKey is GMIGKLWWBFLRRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2Si.CH4/c1-7(2)8(10)6-9(11)12(3,4)5;/h7H,6H2,1-5H3;1H4.
What are the key properties of methane;4-methyl-1-trimethylsilylpentane-1,3-dione?
methane;4-methyl-1-trimethylsilylpentane-1,3-dione has a molecular weight of 202.37 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;4-methyl-1-trimethylsilylpentane-1,3-dione is sourced from PubChem (CID 158299529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).