(5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one

C14H28O4Si — CID 58570960

IUPAC(5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one
SMILESCOC(C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1CCC(=O)O1
InChIInChI=1S/C14H28O4Si/c1-10(16-5)13(11-8-9-12(15)17-11)18-19(6,7)14(2,3)4/h10-11,13H,8-9H2,1-7H3/t10?,11-,13-/m1/s1
InChIKeyUFTDWYABKLDHOJ-LIXJUXSLSA-N
MW288.46 g/mol
LogP3.12
Rot. Bonds5

About (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one

(5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one (PubChem CID 58570960) has the molecular formula C14H28O4Si and a molecular weight of 288.46 g/mol. Its IUPAC name is (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one.

Molecular Properties

Compound Name(5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one
PubChem CID58570960
Molecular FormulaC14H28O4Si
Molecular Weight288.46 g/mol
Exact Mass288.18
IUPAC Name(5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one
SMILESCOC(C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1CCC(=O)O1
InChIInChI=1S/C14H28O4Si/c1-10(16-5)13(11-8-9-12(15)17-11)18-19(6,7)14(2,3)4/h10-11,13H,8-9H2,1-7H3/t10?,11-,13-/m1/s1
InChIKeyUFTDWYABKLDHOJ-LIXJUXSLSA-N
XLogP3.12
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 53.12
H-Bond Donors ≤ 50
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 (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one?
The IUPAC name of (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one (CID 58570960) is (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one.
What is the SMILES notation for (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one?
The canonical SMILES for (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one is COC(C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1CCC(=O)O1.
What is the InChIKey of (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one?
The InChIKey is UFTDWYABKLDHOJ-LIXJUXSLSA-N. The full InChI is InChI=1S/C14H28O4Si/c1-10(16-5)13(11-8-9-12(15)17-11)18-19(6,7)14(2,3)4/h10-11,13H,8-9H2,1-7H3/t10?,11-,13-/m1/s1.
What are the key properties of (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one?
(5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one has a molecular weight of 288.46 g/mol, XLogP of 3.12, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methoxypropyl]oxolan-2-one is sourced from PubChem (CID 58570960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).