tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane

C16H32O2Si — CID 54753895

IUPACtert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane
SMILESC/C=C/CCC1CCC(CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C16H32O2Si/c1-7-8-9-10-14-11-12-15(18-14)13-17-19(5,6)16(2,3)4/h7-8,14-15H,9-13H2,1-6H3/b8-7+
InChIKeyIBKNHINDVOELTE-BQYQJAHWSA-N
MW284.52 g/mol
LogP4.91
Rot. Bonds6

About tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane

tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane (PubChem CID 54753895) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane
PubChem CID54753895
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Nametert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane
SMILESC/C=C/CCC1CCC(CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C16H32O2Si/c1-7-8-9-10-14-11-12-15(18-14)13-17-19(5,6)16(2,3)4/h7-8,14-15H,9-13H2,1-6H3/b8-7+
InChIKeyIBKNHINDVOELTE-BQYQJAHWSA-N
XLogP4.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.52
LogP ≤ 54.91
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

[(2S,5R)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane
CID 25138560
tert-butyl-[(Z,2R,6S)-6-[tert-butyl(dimethyl)silyl]oxyheptadec-8-en-2-yl]oxy-dimethylsilane
CID 25258171
[(2R)-2-[(2S)-5,5-dimethyloxolan-2-yl]-6-methylhept-5-en-2-yl]oxy-tri(propan-2-yl)silane
CID 101396453
[(2R,5S)-5-but-3-enyloxolan-2-yl]methoxy-tert-butyl-dimethylsilane
CID 134862792
tert-butyl-[(2S,3R)-2-[(2E,5E,8E)-deca-2,5,8-trienyl]oxan-3-yl]oxy-dimethylsilane
CID 135077331
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
1-O-Hexadecenylglycerol, bis(trimethylsilyl) ether
CID 91733513
1-O-(9-Octadecenyl)glycerol 2,3-ditrimethylsilyl ether
CID 101618169
[(Z)-2-butoxyhenicos-4-enoxy]-tert-butyl-dimethylsilane
CID 89050163
(11Z,14Z)-1-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]icosa-11,14-dien-2-ol
CID 140750200
1-[2-[Tert-butyl(dimethyl)silyl]oxyethoxy]icosa-11,14-dien-2-ol
CID 154344626

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane (CID 54753895) is tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane is C/C=C/CCC1CCC(CO[Si](C)(C)C(C)(C)C)O1.
What is the InChIKey of tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane?
The InChIKey is IBKNHINDVOELTE-BQYQJAHWSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-7-8-9-10-14-11-12-15(18-14)13-17-19(5,6)16(2,3)4/h7-8,14-15H,9-13H2,1-6H3/b8-7+.
What are the key properties of tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane?
tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane has a molecular weight of 284.52 g/mol, XLogP of 4.91, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[5-[(E)-pent-3-enyl]oxolan-2-yl]methoxy]silane is sourced from PubChem (CID 54753895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).