4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol

C11H24O4Si — CID 20612986

IUPAC4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol
SMILESCC1OC(O)C(O)C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O4Si/c1-7-9(8(12)10(13)14-7)15-16(5,6)11(2,3)4/h7-10,12-13H,1-6H3
InChIKeySWIDLDYVGWZSDA-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.47
Rot. Bonds2

About 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol

4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol (PubChem CID 20612986) has the molecular formula C11H24O4Si and a molecular weight of 248.39 g/mol. Its IUPAC name is 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol.

Molecular Properties

Compound Name4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol
PubChem CID20612986
Molecular FormulaC11H24O4Si
Molecular Weight248.39 g/mol
Exact Mass248.14
IUPAC Name4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol
SMILESCC1OC(O)C(O)C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O4Si/c1-7-9(8(12)10(13)14-7)15-16(5,6)11(2,3)4/h7-10,12-13H,1-6H3
InChIKeySWIDLDYVGWZSDA-UHFFFAOYSA-N
XLogP1.47
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[(2S,3R,4R,5R)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-5-methyloxolan-2-yl]methanol
CID 45277017
(3R,6S)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-6-methoxy-2-methyloxan-3-ol
CID 134971375
(6S,8S,8aS)-7-[tert-butyl(dimethyl)silyl]oxy-6-methyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol
CID 157295900
[(2R,3R,5S,6S)-4-[tert-butyl(dimethyl)silyl]oxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]methanol
CID 44518856
(2R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methyl-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-4-ol
CID 71166590
(1S,2S,3R,4S,5R,6R)-10-[tert-butyl(dimethyl)silyl]oxy-11-propan-2-ylidenetricyclo[4.3.1.12,5]undecane-3,4-diol
CID 11046408
(1R,2S,3R,4R,5R)-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6,8-dioxabicyclo[3.2.1]octan-3-ol
CID 11254343
(2R,3S,4S,5S,6S)-5-methoxy-6-methyloxane-2,3,4-triol
CID 156614259
(3S,4S,10R)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-10-methyloxecan-2-ol
CID 11384956
(2S,3R,4S,5R,6S)-3-[tert-butyl(dimethyl)silyl]oxy-5-[(4-methoxyphenyl)methoxy]-2-methyl-6-phenylsulfanyloxan-4-ol
CID 11225595
(3R,4S,5S,6R)-4-methoxy-6-methyloxane-2,3,5-triol
CID 15558282
tert-butyl-dimethyl-[(2S,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxysilane
CID 59441458

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol?
The IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol (CID 20612986) is 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol.
What is the SMILES notation for 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol?
The canonical SMILES for 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol is CC1OC(O)C(O)C1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol?
The InChIKey is SWIDLDYVGWZSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4Si/c1-7-9(8(12)10(13)14-7)15-16(5,6)11(2,3)4/h7-10,12-13H,1-6H3.
What are the key properties of 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol?
4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol has a molecular weight of 248.39 g/mol, XLogP of 1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(dimethyl)silyl]oxy-5-methyloxolane-2,3-diol is sourced from PubChem (CID 20612986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).