tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane

C17H32O2Si — CID 102171839

IUPACtert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane
SMILESC=C(C)CC1=CCOC1CCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H32O2Si/c1-14(2)13-15-10-12-18-16(15)9-8-11-19-20(6,7)17(3,4)5/h10,16H,1,8-9,11-13H2,2-7H3
InChIKeyJTUVENUXHORECA-UHFFFAOYSA-N
MW296.53 g/mol
LogP5.08
Rot. Bonds7

About tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane

tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane (PubChem CID 102171839) has the molecular formula C17H32O2Si and a molecular weight of 296.53 g/mol. Its IUPAC name is tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane
PubChem CID102171839
Molecular FormulaC17H32O2Si
Molecular Weight296.53 g/mol
Exact Mass296.22
IUPAC Nametert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane
SMILESC=C(C)CC1=CCOC1CCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H32O2Si/c1-14(2)13-15-10-12-18-16(15)9-8-11-19-20(6,7)17(3,4)5/h10,16H,1,8-9,11-13H2,2-7H3
InChIKeyJTUVENUXHORECA-UHFFFAOYSA-N
XLogP5.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.53
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane (CID 102171839) is tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane is C=C(C)CC1=CCOC1CCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane?
The InChIKey is JTUVENUXHORECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O2Si/c1-14(2)13-15-10-12-18-16(15)9-8-11-19-20(6,7)17(3,4)5/h10,16H,1,8-9,11-13H2,2-7H3.
What are the key properties of tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane?
tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane has a molecular weight of 296.53 g/mol, XLogP of 5.08, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[3-[3-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-yl]propoxy]silane is sourced from PubChem (CID 102171839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).