(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one

C12H24O3Si — CID 71732446

IUPAC(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one
SMILESC[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1CCC(=O)O1
InChIInChI=1S/C12H24O3Si/c1-9(10-7-8-11(13)14-10)15-16(5,6)12(2,3)4/h9-10H,7-8H2,1-6H3/t9-,10+/m0/s1
InChIKeyMXOSYMKUCMLIPL-VHSXEESVSA-N
MW244.41 g/mol
LogP3.10
Rot. Bonds3

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

(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one (PubChem CID 71732446) has the molecular formula C12H24O3Si and a molecular weight of 244.41 g/mol. Its IUPAC name is (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one.

Molecular Properties

Compound Name(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one
PubChem CID71732446
Molecular FormulaC12H24O3Si
Molecular Weight244.41 g/mol
Exact Mass244.15
IUPAC Name(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one
SMILESC[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1CCC(=O)O1
InChIInChI=1S/C12H24O3Si/c1-9(10-7-8-11(13)14-10)15-16(5,6)12(2,3)4/h9-10H,7-8H2,1-6H3/t9-,10+/m0/s1
InChIKeyMXOSYMKUCMLIPL-VHSXEESVSA-N
XLogP3.10
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.41
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(5S)-5-{[(tert-butyldimethylsilyl)oxy]methyl}oxolan-2-one
CID 10014094
(2S)-2-[tert-butyl(dimethyl)silyl]oxy-2-[(2R)-5-oxooxolan-2-yl]acetaldehyde
CID 10611248
2,3-Dideoxy-3-C-methyl-5-O-tert-butyldimethylsilyl-D-erythro-pentono-1,4-lactone
CID 102292925
5-[1-[Tert-butyl(dimethyl)silyl]oxy-2,2,2-trifluoroethyl]oxolan-2-one
CID 54542353
(5R)-5-[(1R)-1,2-bis[[tert-butyl(dimethyl)silyl]oxy]ethyl]oxolan-2-one
CID 10499676
(3S,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-methyloxolan-2-one
CID 10729014
(4S,5S)-5-[(1S)-1-hydroxyethyl]-4-trimethylsilyloxolan-2-one
CID 13789597
(5S)-5-[[tert-butyl(dimethyl)silyl]oxy-[(2S)-5-oxooxolan-2-yl]methyl]oxolan-2-one
CID 14658518
5-Triethylsilyloxy-epsilon-caprolactone
CID 129835249
(5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-hydroxyethyl]oxolan-2-one
CID 134840108
(3R,3aS,6aR)-3-[tert-butyl(dimethyl)silyl]oxy-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-5-one
CID 134849405
(5R)-5-[(1R)-1-tri(propan-2-yl)silyloxytridecyl]oxolan-2-one
CID 134939638

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one?
The IUPAC name of (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one (CID 71732446) is (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one.
What is the SMILES notation for (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one?
The canonical SMILES for (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one is C[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1CCC(=O)O1.
What is the InChIKey of (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one?
The InChIKey is MXOSYMKUCMLIPL-VHSXEESVSA-N. The full InChI is InChI=1S/C12H24O3Si/c1-9(10-7-8-11(13)14-10)15-16(5,6)12(2,3)4/h9-10H,7-8H2,1-6H3/t9-,10+/m0/s1.
What are the key properties of (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one?
(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one has a molecular weight of 244.41 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-one is sourced from PubChem (CID 71732446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).