[3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol

C14H30O4Si — CID 19699695

IUPAC[3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol
SMILESCOC1C(C)COC(CO)C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30O4Si/c1-10-9-17-11(8-15)13(12(10)16-5)18-19(6,7)14(2,3)4/h10-13,15H,8-9H2,1-7H3
InChIKeyYBKKNJZOTAHCLV-UHFFFAOYSA-N
MW290.48 g/mol
LogP2.42
Rot. Bonds4

About [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol

[3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol (PubChem CID 19699695) has the molecular formula C14H30O4Si and a molecular weight of 290.48 g/mol. Its IUPAC name is [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol.

Molecular Properties

Compound Name[3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol
PubChem CID19699695
Molecular FormulaC14H30O4Si
Molecular Weight290.48 g/mol
Exact Mass290.19
IUPAC Name[3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol
SMILESCOC1C(C)COC(CO)C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30O4Si/c1-10-9-17-11(8-15)13(12(10)16-5)18-19(6,7)14(2,3)4/h10-13,15H,8-9H2,1-7H3
InChIKeyYBKKNJZOTAHCLV-UHFFFAOYSA-N
XLogP2.42
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.48
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol?
The IUPAC name of [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol (CID 19699695) is [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol.
What is the SMILES notation for [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol?
The canonical SMILES for [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol is COC1C(C)COC(CO)C1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol?
The InChIKey is YBKKNJZOTAHCLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O4Si/c1-10-9-17-11(8-15)13(12(10)16-5)18-19(6,7)14(2,3)4/h10-13,15H,8-9H2,1-7H3.
What are the key properties of [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol?
[3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol has a molecular weight of 290.48 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol is sourced from PubChem (CID 19699695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).