2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol

C23H48O3SiSn — CID 73077255

IUPAC2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol
SMILESCCCC[Sn](CCCC)(CCCC)C1=CC(O)C(CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C11H21O3Si.3C4H9.Sn/c1-11(2,3)15(4,5)14-8-10-9(12)6-7-13-10;3*1-3-4-2;/h6,9-10,12H,8H2,1-5H3;3*1,3-4H2,2H3;
InChIKeyKEFKVVAZTPCBBJ-UHFFFAOYSA-N
MW519.43 g/mol
LogP7.04
Rot. Bonds13

About 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol

2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol (PubChem CID 73077255) has the molecular formula C23H48O3SiSn and a molecular weight of 519.43 g/mol. Its IUPAC name is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol.

Molecular Properties

Compound Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol
PubChem CID73077255
Molecular FormulaC23H48O3SiSn
Molecular Weight519.43 g/mol
Exact Mass520.24
IUPAC Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol
SMILESCCCC[Sn](CCCC)(CCCC)C1=CC(O)C(CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C11H21O3Si.3C4H9.Sn/c1-11(2,3)15(4,5)14-8-10-9(12)6-7-13-10;3*1-3-4-2;/h6,9-10,12H,8H2,1-5H3;3*1,3-4H2,2H3;
InChIKeyKEFKVVAZTPCBBJ-UHFFFAOYSA-N
XLogP7.04
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms28
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500519.43
LogP ≤ 57.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S,3R,4S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methyl-3,4-dihydro-2H-pyran-4-ol
CID 53764004
[(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydrofuran-2-yl]methanol
CID 11333702
(4S)-4-[tert-butyl(dimethyl)silyl]oxy-2-methoxypent-1-en-3-ol
CID 134836233
tert-butyl-[[(2R,3S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-yl]oxy]-dimethylsilane
CID 134974943
[(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydrofuran-2-yl]methanol
CID 135042815
(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methoxyhexa-4,5-dien-3-ol
CID 135072414
(2S,3R,4R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methyl-3,4-dihydro-2H-pyran-4-ol
CID 10657969
(2R,3S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydrofuran-3-ol
CID 10998822
(2S,3R,4S)-6-[butyl(dimethyl)silyl]-2-methyl-3,4-dihydro-2H-pyran-3,4-diol
CID 70355099
2-(Trimethylsilyloxymethyl)-2,3-dihydrofuran-3-ol
CID 173581661
(3S,4S)-2-ethoxy-4-tri(propan-2-yl)silyloxypent-1-en-3-ol
CID 11098695
(2R,3S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol
CID 11731020

Frequently Asked Questions

What is the IUPAC name of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol?
The IUPAC name of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol (CID 73077255) is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol.
What is the SMILES notation for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol?
The canonical SMILES for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol is CCCC[Sn](CCCC)(CCCC)C1=CC(O)C(CO[Si](C)(C)C(C)(C)C)O1.
What is the InChIKey of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol?
The InChIKey is KEFKVVAZTPCBBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21O3Si.3C4H9.Sn/c1-11(2,3)15(4,5)14-8-10-9(12)6-7-13-10;3*1-3-4-2;/h6,9-10,12H,8H2,1-5H3;3*1,3-4H2,2H3;.
What are the key properties of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol?
2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol has a molecular weight of 519.43 g/mol, XLogP of 7.04, 13 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-tributylstannyl-2,3-dihydrofuran-3-ol is sourced from PubChem (CID 73077255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).