[(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane

C15H30O2Si — CID 25138560

IUPAC[(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane
SMILESC=CCC[C@@H]1CC[C@@H](CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C15H30O2Si/c1-7-8-9-13-10-11-14(17-13)12-16-18(5,6)15(2,3)4/h7,13-14H,1,8-12H2,2-6H3/t13-,14+/m1/s1
InChIKeyXDHLENNHFPRYAK-KGLIPLIRSA-N
MW270.49 g/mol
LogP4.52
Rot. Bonds6

About [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane

[(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane (PubChem CID 25138560) has the molecular formula C15H30O2Si and a molecular weight of 270.49 g/mol. Its IUPAC name is [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane
PubChem CID25138560
Molecular FormulaC15H30O2Si
Molecular Weight270.49 g/mol
Exact Mass270.20
IUPAC Name[(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane
SMILESC=CCC[C@@H]1CC[C@@H](CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C15H30O2Si/c1-7-8-9-13-10-11-14(17-13)12-16-18(5,6)15(2,3)4/h7,13-14H,1,8-12H2,2-6H3/t13-,14+/m1/s1
InChIKeyXDHLENNHFPRYAK-KGLIPLIRSA-N
XLogP4.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[(3S,5R)-5-prop-2-enyloxolan-3-yl]oxysilane
CID 101748377
[(2R,5S)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane
CID 134862792
tert-butyl-dimethyl-[(3S,5S)-5-prop-2-enyloxolan-3-yl]oxysilane
CID 134996026
tert-butyl-[(1R)-1-[(2R,5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyhex-5-enyl]oxolan-2-yl]tridecoxy]-dimethylsilane
CID 138977972
[(2R,3S)-2-but-3-enyloxepan-3-yl]oxy-tert-butyl-dimethylsilane
CID 9971146
(1S)-1-[(2R,4S,5S)-4-[tert-butyl(dimethyl)silyl]oxy-5-pentyloxolan-2-yl]dec-9-en-1-ol
CID 10670138
Tert-butyl-dimethyl-[(6-prop-2-enyloxan-2-yl)methoxy]silane
CID 67763386
tert-butyl-dimethyl-[[(2R,6R)-6-prop-2-enyloxan-2-yl]methoxy]silane
CID 139772792
(1S)-1-[(2R)-3-[tert-butyl(dimethyl)silyl]oxyoxolan-2-yl]but-3-en-1-ol
CID 173671353
[(2R)-2-but-3-enyloxolan-3-yl]oxy-tert-butyl-dimethylsilane
CID 173791779
(1R)-1-[(2R)-3-[tert-butyl(dimethyl)silyl]oxyoxolan-2-yl]but-3-en-1-ol
CID 173904309
[(2R,3S)-2-but-3-enyloxan-3-yl]oxy-tert-butyl-dimethylsilane
CID 9970384

Frequently Asked Questions

What is the IUPAC name of [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane?
The IUPAC name of [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane (CID 25138560) is [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane?
The canonical SMILES for [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane is C=CCC[C@@H]1CC[C@@H](CO[Si](C)(C)C(C)(C)C)O1.
What is the InChIKey of [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane?
The InChIKey is XDHLENNHFPRYAK-KGLIPLIRSA-N. The full InChI is InChI=1S/C15H30O2Si/c1-7-8-9-13-10-11-14(17-13)12-16-18(5,6)15(2,3)4/h7,13-14H,1,8-12H2,2-6H3/t13-,14+/m1/s1.
What are the key properties of [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane?
[(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane has a molecular weight of 270.49 g/mol, XLogP of 4.52, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 25138560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).