2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one

C13H26O5Si2 — CID 59470607

IUPAC2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one
SMILESCC1=C(O[Si](C)(C)C)C(C(O)CO[Si](C)(C)C)OC1=O
InChIInChI=1S/C13H26O5Si2/c1-9-11(18-20(5,6)7)12(17-13(9)15)10(14)8-16-19(2,3)4/h10,12,14H,8H2,1-7H3
InChIKeyLORXIRQNUFBDNT-UHFFFAOYSA-N
MW318.52 g/mol
LogP2.25
Rot. Bonds6

About 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one

2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one (PubChem CID 59470607) has the molecular formula C13H26O5Si2 and a molecular weight of 318.52 g/mol. Its IUPAC name is 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one.

Molecular Properties

Compound Name2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one
PubChem CID59470607
Molecular FormulaC13H26O5Si2
Molecular Weight318.52 g/mol
Exact Mass318.13
IUPAC Name2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one
SMILESCC1=C(O[Si](C)(C)C)C(C(O)CO[Si](C)(C)C)OC1=O
InChIInChI=1S/C13H26O5Si2/c1-9-11(18-20(5,6)7)12(17-13(9)15)10(14)8-16-19(2,3)4/h10,12,14H,8H2,1-7H3
InChIKeyLORXIRQNUFBDNT-UHFFFAOYSA-N
XLogP2.25
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.52
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[2-(3,4-dimethyl-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] formate
CID 23538080
2-[1-hydroxy-2-(oxomethoxy)ethyl]-3,4-dimethyl-2H-furan-5-one;yttrium(3+)
CID 23538079
(5R)-5-[(1S)-1-hydroxy-2-[(2-methylpropan-2-yl)oxy]ethyl]oxolane-2,3,4-trione
CID 90305836
5-(2-aminooxy-1-hydroxyethyl)oxolane-2,3,4-trione
CID 123765644
(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-[[(2R)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-5-oxo-2H-furan-3-yl]oxy]-4-hydroxy-2H-furan-5-one
CID 66655329
2-(1-hydroxy-2-methoxyethyl)-3,4-bis(phenylmethoxy)-2H-furan-5-one
CID 142525192
(3R)-3-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-hydroxyethyl]-5,6-dimethoxy-3H-2-benzofuran-1-one
CID 57409059
[2-hydroxy-2-(3-hydroxy-4-methoxy-5-oxo-2H-furan-2-yl)ethyl] acetate
CID 54732327
[(2S)-2-[(2R)-3,4-dihydroxy-5-oxo-2H-furan-2-yl]-2-hydroxyethyl] propanoate
CID 71656699
(2R)-2-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-hydroxyethyl]-2,3-dihydropyran-6-one
CID 11780673
(2R)-3,4-dihydroxy-2-[(1R)-1-hydroxy-2-(3-methylbutoxy)ethyl]-2H-furan-5-one
CID 54685948
(2R)-3-butoxy-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-2H-furan-5-one
CID 18600208

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one?
The IUPAC name of 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one (CID 59470607) is 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one.
What is the SMILES notation for 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one?
The canonical SMILES for 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one is CC1=C(O[Si](C)(C)C)C(C(O)CO[Si](C)(C)C)OC1=O.
What is the InChIKey of 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one?
The InChIKey is LORXIRQNUFBDNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O5Si2/c1-9-11(18-20(5,6)7)12(17-13(9)15)10(14)8-16-19(2,3)4/h10,12,14H,8H2,1-7H3.
What are the key properties of 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one?
2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one has a molecular weight of 318.52 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxy-2-trimethylsilyloxyethyl)-4-methyl-3-trimethylsilyloxy-2H-furan-5-one is sourced from PubChem (CID 59470607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).