[(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane

C17H34O6Si — CID 51357192

IUPAC[(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane
SMILESCOC[C@@]1(CO[Si](C)(C)C(C)(C)C)O[C@@H]2OC(C)(C)O[C@@H]2[C@H]1OC
InChIInChI=1S/C17H34O6Si/c1-15(2,3)24(8,9)20-11-17(10-18-6)13(19-7)12-14(23-17)22-16(4,5)21-12/h12-14H,10-11H2,1-9H3/t12-,13-,14+,17+/m1/s1
InChIKeyTYQGAAYAQWNOMS-WVZRYYJFSA-N
MW362.54 g/mol
LogP2.92
Rot. Bonds6

About [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane

[(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane (PubChem CID 51357192) has the molecular formula C17H34O6Si and a molecular weight of 362.54 g/mol. Its IUPAC name is [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane
PubChem CID51357192
Molecular FormulaC17H34O6Si
Molecular Weight362.54 g/mol
Exact Mass362.21
IUPAC Name[(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane
SMILESCOC[C@@]1(CO[Si](C)(C)C(C)(C)C)O[C@@H]2OC(C)(C)O[C@@H]2[C@H]1OC
InChIInChI=1S/C17H34O6Si/c1-15(2,3)24(8,9)20-11-17(10-18-6)13(19-7)12-14(23-17)22-16(4,5)21-12/h12-14H,10-11H2,1-9H3/t12-,13-,14+,17+/m1/s1
InChIKeyTYQGAAYAQWNOMS-WVZRYYJFSA-N
XLogP2.92
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.54
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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 [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane?
The IUPAC name of [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane (CID 51357192) is [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane?
The canonical SMILES for [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane is COC[C@@]1(CO[Si](C)(C)C(C)(C)C)O[C@@H]2OC(C)(C)O[C@@H]2[C@H]1OC.
What is the InChIKey of [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane?
The InChIKey is TYQGAAYAQWNOMS-WVZRYYJFSA-N. The full InChI is InChI=1S/C17H34O6Si/c1-15(2,3)24(8,9)20-11-17(10-18-6)13(19-7)12-14(23-17)22-16(4,5)21-12/h12-14H,10-11H2,1-9H3/t12-,13-,14+,17+/m1/s1.
What are the key properties of [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane?
[(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane has a molecular weight of 362.54 g/mol, XLogP of 2.92, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(3aR,5S,6R,6aR)-6-methoxy-5-(methoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 51357192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).