tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane

C27H34O3Si — CID 11293453

IUPACtert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane
SMILESC=CCOc1c2occ(C=C)c2c(C)c2ccc3c(c12)CCC3O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C27H34O3Si/c1-9-15-28-26-24-19(17(3)23-18(10-2)16-29-25(23)26)11-12-20-21(24)13-14-22(20)30-31(7,8)27(4,5)6/h9-12,16,22H,1-2,13-15H2,3-8H3
InChIKeyHTOCMNZGVMHYJV-UHFFFAOYSA-N
MW434.65 g/mol
LogP8.11
Rot. Bonds6

About tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane

tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane (PubChem CID 11293453) has the molecular formula C27H34O3Si and a molecular weight of 434.65 g/mol. Its IUPAC name is tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane
PubChem CID11293453
Molecular FormulaC27H34O3Si
Molecular Weight434.65 g/mol
Exact Mass434.23
IUPAC Nametert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane
SMILESC=CCOc1c2occ(C=C)c2c(C)c2ccc3c(c12)CCC3O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C27H34O3Si/c1-9-15-28-26-24-19(17(3)23-18(10-2)16-29-25(23)26)11-12-20-21(24)13-14-22(20)30-31(7,8)27(4,5)6/h9-12,16,22H,1-2,13-15H2,3-8H3
InChIKeyHTOCMNZGVMHYJV-UHFFFAOYSA-N
XLogP8.11
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.65
LogP ≤ 58.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-4-yl]pent-4-en-1-one
CID 123160452
tert-butyl-[[4-[2-(2,2-dimethylpropoxy)-3-pyridinyl]-2,3-dihydro-1H-inden-1-yl]oxy]-dimethylsilane
CID 123807630
1-[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-4-yl]-1,1-difluoro-2-methylpropan-2-ol
CID 77360299
tert-butyl-[[4-(1-methoxycyclobutyl)-2,3-dihydro-1H-inden-1-yl]oxy]-dimethylsilane
CID 67814830
[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-4-yl]-cyclobutylmethanol
CID 67812161
[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-4-yl]-(2,3-dimethylbutan-2-yloxy)methanol
CID 175133450
tert-butyl-[[4-(4-ethyl-3,3-dimethyloxetan-2-yl)-2,3-dihydro-1H-inden-1-yl]oxy]-dimethylsilane
CID 123396288
1-[tert-butyl(dimethyl)silyl]oxy-4-[(6-chloro-3-pyridinyl)methyl]-2,3-dihydro-1H-indene-5-carbonitrile
CID 123649519
tert-butyl-dimethyl-[(4-methylidene-2,3-dihydro-1H-naphthalen-1-yl)oxy]silane
CID 134980286
N-[[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-5-yl]methylidene]hydroxylamine
CID 150629221
(3R)-3-[tert-butyl(dimethyl)silyl]oxy-1-prop-2-enylpiperidine-2,6-dione
CID 46844725
[3-bromo-2-(4-methylphenyl)cyclopent-2-en-1-yl]oxy-tert-butyl-dimethylsilane
CID 138111138

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane (CID 11293453) is tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane is C=CCOc1c2occ(C=C)c2c(C)c2ccc3c(c12)CCC3O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane?
The InChIKey is HTOCMNZGVMHYJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34O3Si/c1-9-15-28-26-24-19(17(3)23-18(10-2)16-29-25(23)26)11-12-20-21(24)13-14-22(20)30-31(7,8)27(4,5)6/h9-12,16,22H,1-2,13-15H2,3-8H3.
What are the key properties of tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane?
tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane has a molecular weight of 434.65 g/mol, XLogP of 8.11, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(7-ethenyl-6-methyl-10-prop-2-enoxy-2,3-dihydro-1H-indeno[5,4-f][1]benzofuran-3-yl)oxy]-dimethylsilane is sourced from PubChem (CID 11293453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).