2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one

C10H18O4Si — CID 86063697

IUPAC2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one
SMILESC[Si](C)(C)CCOC1=CC(=O)OC1CO
InChIInChI=1S/C10H18O4Si/c1-15(2,3)5-4-13-8-6-10(12)14-9(8)7-11/h6,9,11H,4-5,7H2,1-3H3
InChIKeyPWVVJHVURGYYGA-UHFFFAOYSA-N
MW230.34 g/mol
LogP1.14
Rot. Bonds5

About 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one

2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one (PubChem CID 86063697) has the molecular formula C10H18O4Si and a molecular weight of 230.34 g/mol. Its IUPAC name is 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one.

Molecular Properties

Compound Name2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one
PubChem CID86063697
Molecular FormulaC10H18O4Si
Molecular Weight230.34 g/mol
Exact Mass230.10
IUPAC Name2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one
SMILESC[Si](C)(C)CCOC1=CC(=O)OC1CO
InChIInChI=1S/C10H18O4Si/c1-15(2,3)5-4-13-8-6-10(12)14-9(8)7-11/h6,9,11H,4-5,7H2,1-3H3
InChIKeyPWVVJHVURGYYGA-UHFFFAOYSA-N
XLogP1.14
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.34
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(hydroxymethyl)-3-methoxy-2H-furan-5-one
CID 56773936
2-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-3-methoxy-2H-furan-5-one
CID 134857738
2-[(1R)-1-hydroxyethyl]-4-trimethylsilyl-2H-furan-5-one
CID 134905880
ethyl (E,4R,5R)-6-[tert-butyl(dimethyl)silyl]oxy-5-hydroxy-4-methoxyhex-2-enoate
CID 135024557
(2R)-2-[(1S)-2-[tert-butyl(dimethyl)silyl]oxy-1-hydroxyethyl]-2H-furan-5-one
CID 135075701
2-(1,2-dihydroxyethyl)-4-hydroxy-3-(trimethylsilylmethoxy)-2H-furan-5-one
CID 15511275
2-(1,2-dihydroxyethyl)-4-hydroxy-3-(3-trimethylsilylpropoxy)-2H-furan-5-one
CID 23497843
2-(1,2-dihydroxyethyl)-3-hydroxy-4-(3-trimethylsilylpropoxy)-2H-furan-5-one
CID 54715949
2-[hydroxy-tri(propan-2-yl)silylmethyl]-2H-furan-5-one
CID 69559407
[2-(Hydroxymethyl)-5-methyl-2,5-dihydrofuran-3-yl] acetate
CID 134369422
4-hydroxy-2-(1-hydroxyethyl)-3-(trimethylsilylmethoxy)-2H-furan-5-one
CID 139947884
(2S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,4-dihydroxy-2H-furan-5-one
CID 140657990

Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one?
The IUPAC name of 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one (CID 86063697) is 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one.
What is the SMILES notation for 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one?
The canonical SMILES for 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one is C[Si](C)(C)CCOC1=CC(=O)OC1CO.
What is the InChIKey of 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one?
The InChIKey is PWVVJHVURGYYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O4Si/c1-15(2,3)5-4-13-8-6-10(12)14-9(8)7-11/h6,9,11H,4-5,7H2,1-3H3.
What are the key properties of 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one?
2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one has a molecular weight of 230.34 g/mol, XLogP of 1.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-3-(2-trimethylsilylethoxy)-2H-furan-5-one is sourced from PubChem (CID 86063697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).