tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane

C14H24O2Si — CID 134863497

IUPACtert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane
SMILESCC(C)(C)[Si](C)(C)OC1=CC2=C(CC1)COC2
InChIInChI=1S/C14H24O2Si/c1-14(2,3)17(4,5)16-13-7-6-11-9-15-10-12(11)8-13/h8H,6-7,9-10H2,1-5H3
InChIKeyLEXCJXLKEQWODI-UHFFFAOYSA-N
MW252.43 g/mol
LogP4.01
Rot. Bonds2

About tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane

tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane (PubChem CID 134863497) has the molecular formula C14H24O2Si and a molecular weight of 252.43 g/mol. Its IUPAC name is tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane
PubChem CID134863497
Molecular FormulaC14H24O2Si
Molecular Weight252.43 g/mol
Exact Mass252.15
IUPAC Nametert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane
SMILESCC(C)(C)[Si](C)(C)OC1=CC2=C(CC1)COC2
InChIInChI=1S/C14H24O2Si/c1-14(2,3)17(4,5)16-13-7-6-11-9-15-10-12(11)8-13/h8H,6-7,9-10H2,1-5H3
InChIKeyLEXCJXLKEQWODI-UHFFFAOYSA-N
XLogP4.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2-(Ethoxymethyl)cyclohexa-1,3-dien-1-yl]oxy-triethylsilane
CID 176427842
tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane
CID 11208333
Tert-butyl-dimethyl-[3-(4-prop-1-en-2-yl-2,5-dihydrofuran-2-yl)propoxy]silane
CID 11414876

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane (CID 134863497) is tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane is CC(C)(C)[Si](C)(C)OC1=CC2=C(CC1)COC2.
What is the InChIKey of tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane?
The InChIKey is LEXCJXLKEQWODI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2Si/c1-14(2,3)17(4,5)16-13-7-6-11-9-15-10-12(11)8-13/h8H,6-7,9-10H2,1-5H3.
What are the key properties of tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane?
tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane has a molecular weight of 252.43 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane is sourced from PubChem (CID 134863497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).