1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one

C12H28O2Si2 — CID 14640995

IUPAC1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one
SMILESCO[Si](C)(C)C(C(=O)C(C)(C)C)[Si](C)(C)C
InChIInChI=1S/C12H28O2Si2/c1-12(2,3)10(13)11(15(5,6)7)16(8,9)14-4/h11H,1-9H3
InChIKeyBOLBSVXRBZUDIQ-UHFFFAOYSA-N
MW260.53 g/mol
LogP3.70
Rot. Bonds4

About 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one

1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one (PubChem CID 14640995) has the molecular formula C12H28O2Si2 and a molecular weight of 260.53 g/mol. Its IUPAC name is 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one.

Molecular Properties

Compound Name1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one
PubChem CID14640995
Molecular FormulaC12H28O2Si2
Molecular Weight260.53 g/mol
Exact Mass260.16
IUPAC Name1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one
SMILESCO[Si](C)(C)C(C(=O)C(C)(C)C)[Si](C)(C)C
InChIInChI=1S/C12H28O2Si2/c1-12(2,3)10(13)11(15(5,6)7)16(8,9)14-4/h11H,1-9H3
InChIKeyBOLBSVXRBZUDIQ-UHFFFAOYSA-N
XLogP3.70
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.53
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,3-Dimethyl-1-trimethylsilylbutan-2-one
CID 13540822
4-[Tert-butyl(dimethyl)silyl]oxy-3,3-dimethylbutan-2-one
CID 12098487
3,3-Dimethyl-1-triethylsilylbutan-2-one
CID 13540823
1-[Dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one
CID 58805551
4-[Bis(dimethylsilyloxy)-methylsilyl]-3-methylbutan-2-one
CID 157735300
1-Dimethylsilyl-3,3-dimethylbutane-1,2-dione
CID 173326149
7-[Tert-butyl(dimethyl)silyl]oxy-2,2-dimethylhept-4-yn-3-one
CID 10978486
1-[Tert-butyl(dimethyl)silyl]oxy-3,3-dimethylbutan-2-one
CID 11701393
3,3-Dimethyl-4-triethylsilyloxybutan-2-one
CID 12008020
1-[3,3-Dimethylbutyl(dimethyl)silyl]butane-1,3-dione
CID 101255815
3,3-Dimethyl-1-trimethylsilylbutane-1,2-dione
CID 158093615
4,4-Dimethyl-1-trimethoxysilylpentan-3-one
CID 161667443

Frequently Asked Questions

What is the IUPAC name of 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one?
The IUPAC name of 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one (CID 14640995) is 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one.
What is the SMILES notation for 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one?
The canonical SMILES for 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one is CO[Si](C)(C)C(C(=O)C(C)(C)C)[Si](C)(C)C.
What is the InChIKey of 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one?
The InChIKey is BOLBSVXRBZUDIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O2Si2/c1-12(2,3)10(13)11(15(5,6)7)16(8,9)14-4/h11H,1-9H3.
What are the key properties of 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one?
1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one has a molecular weight of 260.53 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methoxy(dimethyl)silyl]-3,3-dimethyl-1-trimethylsilylbutan-2-one is sourced from PubChem (CID 14640995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).