tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane

C19H40O4Si2 — CID 23240877

IUPACtert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane
SMILESC=CC1O[C@@H](CO[Si](C)(C)C(C)(C)C)[C@H](CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C19H40O4Si2/c1-12-17-22-15(13-20-24(8,9)18(2,3)4)16(23-17)14-21-25(10,11)19(5,6)7/h12,15-17H,1,13-14H2,2-11H3/t15-,16-/m0/s1
InChIKeyFBNXZDXSJPJRBQ-HOTGVXAUSA-N
MW388.70 g/mol
LogP5.33
Rot. Bonds7

About tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane

tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane (PubChem CID 23240877) has the molecular formula C19H40O4Si2 and a molecular weight of 388.70 g/mol. Its IUPAC name is tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane
PubChem CID23240877
Molecular FormulaC19H40O4Si2
Molecular Weight388.70 g/mol
Exact Mass388.25
IUPAC Nametert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane
SMILESC=CC1O[C@@H](CO[Si](C)(C)C(C)(C)C)[C@H](CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C19H40O4Si2/c1-12-17-22-15(13-20-24(8,9)18(2,3)4)16(23-17)14-21-25(10,11)19(5,6)7/h12,15-17H,1,13-14H2,2-11H3/t15-,16-/m0/s1
InChIKeyFBNXZDXSJPJRBQ-HOTGVXAUSA-N
XLogP5.33
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.70
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-[3-prop-2-enoxy-2-(2-trimethylsilylethoxymethoxy)propoxy]silane
CID 11143315
[(3aR,6R,7S,7aR)-2,2-dimethyl-6-prop-2-enoxy-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]oxy-tert-butyl-dimethylsilane
CID 10991555
(6aR,8R,9R,9aR)-8-methoxy-2,2,4,4-tetra(propan-2-yl)-9-prop-2-enoxy-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocine
CID 164930812
[1-[(2,2-Dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane
CID 165098217
Tert-butyl-[(2-ethenyl-1,3-dioxolan-4-yl)methoxy]-dimethylsilane
CID 10900882
tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-[(E)-prop-1-enyl]-1,3-dioxolan-4-yl]methoxy]-dimethylsilane
CID 23240870
[(4R,5R)-2-[(E)-but-2-en-2-yl]-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-dioxolan-4-yl]methoxy-tert-butyl-dimethylsilane
CID 23240874
ethyl (E)-3-[(4S,5S)-4,5-bis[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-dioxolan-2-yl]prop-2-enoate
CID 23240876
tert-butyl-[(2R)-2-(1-ethoxyprop-2-enoxy)-4-methoxypent-4-enoxy]-dimethylsilane
CID 24823868
Methyl 2,3-bis-O-[tert-butyl(dimethyl)silyl]-5,6-dideoxy-alpha-L-lyxo-hex-5-enofuranoside
CID 99772841
tert-butyl-[(2R,3S,4S,5S)-4-[tert-butyl(dimethyl)silyl]oxy-2-ethenyl-5-methoxyoxolan-3-yl]oxy-dimethylsilane
CID 101004847
[(Z)-3-[(3S)-2-methoxyoxolan-3-yl]oxyprop-1-enyl]-trimethylsilane
CID 102380575

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane (CID 23240877) is tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane is C=CC1O[C@@H](CO[Si](C)(C)C(C)(C)C)[C@H](CO[Si](C)(C)C(C)(C)C)O1.
What is the InChIKey of tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane?
The InChIKey is FBNXZDXSJPJRBQ-HOTGVXAUSA-N. The full InChI is InChI=1S/C19H40O4Si2/c1-12-17-22-15(13-20-24(8,9)18(2,3)4)16(23-17)14-21-25(10,11)19(5,6)7/h12,15-17H,1,13-14H2,2-11H3/t15-,16-/m0/s1.
What are the key properties of tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane?
tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane has a molecular weight of 388.70 g/mol, XLogP of 5.33, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethenyl-1,3-dioxolan-4-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 23240877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).