[(3E)-3-benzylideneinden-1-yl]-trimethylsilane

C19H20Si — CID 13210915

IUPAC[(3E)-3-benzylideneinden-1-yl]-trimethylsilane
SMILESC[Si](C)(C)C1=C/C(=C\c2ccccc2)c2ccccc21
InChIInChI=1S/C19H20Si/c1-20(2,3)19-14-16(13-15-9-5-4-6-10-15)17-11-7-8-12-18(17)19/h4-14H,1-3H3/b16-13+
InChIKeyBUOXGMPQXWOCAW-DTQAZKPQSA-N
MW276.45 g/mol
LogP5.50
Rot. Bonds2

About [(3E)-3-benzylideneinden-1-yl]-trimethylsilane

[(3E)-3-benzylideneinden-1-yl]-trimethylsilane (PubChem CID 13210915) has the molecular formula C19H20Si and a molecular weight of 276.45 g/mol. Its IUPAC name is [(3E)-3-benzylideneinden-1-yl]-trimethylsilane.

Molecular Properties

Compound Name[(3E)-3-benzylideneinden-1-yl]-trimethylsilane
PubChem CID13210915
Molecular FormulaC19H20Si
Molecular Weight276.45 g/mol
Exact Mass276.13
IUPAC Name[(3E)-3-benzylideneinden-1-yl]-trimethylsilane
SMILESC[Si](C)(C)C1=C/C(=C\c2ccccc2)c2ccccc21
InChIInChI=1S/C19H20Si/c1-20(2,3)19-14-16(13-15-9-5-4-6-10-15)17-11-7-8-12-18(17)19/h4-14H,1-3H3/b16-13+
InChIKeyBUOXGMPQXWOCAW-DTQAZKPQSA-N
XLogP5.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.45
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(1E)-1-[(4-methylphenyl)methylidene]-3-phenylindene
CID 138968051
(3Z)-3-benzylidene-5-methylfuran-2-one
CID 121009416
8-benzylidene-7-oxabicyclo[4.2.0]octa-1,3,5-triene
CID 70426487
propyl (3E)-3-benzylideneindene-1-carboxylate
CID 142730272
(3Z)-3-[(4-methoxyphenyl)methylidene]indene-1-carbaldehyde
CID 177419708
(3R,4Z)-4-benzylidene-3-methylisochromen-1-one
CID 102435181
(4Z)-4-benzylidene-3-methylisochromen-1-one
CID 101269564
(1E,3Z)-1-benzylidene-3-[[dimethyl(phenyl)silyl]methylidene]inden-2-one
CID 24858896
(2E)-2-benzylidene-4-methylpyrrole
CID 163427119
3-benzylidene-2-benzofuran-1-thione
CID 71400052
(4Z)-4-[(2,6-dimethylpyrylium-4-yl)methylidene]-2-phenylchromene
CID 137292692
3-benzylidene-1-benzofuran
CID 72960863

Frequently Asked Questions

What is the IUPAC name of [(3E)-3-benzylideneinden-1-yl]-trimethylsilane?
The IUPAC name of [(3E)-3-benzylideneinden-1-yl]-trimethylsilane (CID 13210915) is [(3E)-3-benzylideneinden-1-yl]-trimethylsilane.
What is the SMILES notation for [(3E)-3-benzylideneinden-1-yl]-trimethylsilane?
The canonical SMILES for [(3E)-3-benzylideneinden-1-yl]-trimethylsilane is C[Si](C)(C)C1=C/C(=C\c2ccccc2)c2ccccc21.
What is the InChIKey of [(3E)-3-benzylideneinden-1-yl]-trimethylsilane?
The InChIKey is BUOXGMPQXWOCAW-DTQAZKPQSA-N. The full InChI is InChI=1S/C19H20Si/c1-20(2,3)19-14-16(13-15-9-5-4-6-10-15)17-11-7-8-12-18(17)19/h4-14H,1-3H3/b16-13+.
What are the key properties of [(3E)-3-benzylideneinden-1-yl]-trimethylsilane?
[(3E)-3-benzylideneinden-1-yl]-trimethylsilane has a molecular weight of 276.45 g/mol, XLogP of 5.50, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E)-3-benzylideneinden-1-yl]-trimethylsilane is sourced from PubChem (CID 13210915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).