3-trimethylsilyloxyprop-1-enylideneiron(1+)

C6H12FeOSi+ — CID 11050885

IUPAC3-trimethylsilyloxyprop-1-enylideneiron(1+)
SMILESC[Si](C)(C)OCC=C=[Fe+]
InChIInChI=1S/C6H12OSi.Fe/c1-5-6-7-8(2,3)4;/h5H,6H2,2-4H3;/q;+1
InChIKeyQTRDTDUVQWKQGM-UHFFFAOYSA-N
MW184.09 g/mol
LogP1.34
Rot. Bonds3

About 3-trimethylsilyloxyprop-1-enylideneiron(1+)

3-trimethylsilyloxyprop-1-enylideneiron(1+) (PubChem CID 11050885) has the molecular formula C6H12FeOSi+ and a molecular weight of 184.09 g/mol. Its IUPAC name is 3-trimethylsilyloxyprop-1-enylideneiron(1+).

Molecular Properties

Compound Name3-trimethylsilyloxyprop-1-enylideneiron(1+)
PubChem CID11050885
Molecular FormulaC6H12FeOSi+
Molecular Weight184.09 g/mol
Exact Mass184.00
IUPAC Name3-trimethylsilyloxyprop-1-enylideneiron(1+)
SMILESC[Si](C)(C)OCC=C=[Fe+]
InChIInChI=1S/C6H12OSi.Fe/c1-5-6-7-8(2,3)4;/h5H,6H2,2-4H3;/q;+1
InChIKeyQTRDTDUVQWKQGM-UHFFFAOYSA-N
XLogP1.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.09
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-trimethylsilyloxyprop-1-enylideneiron(1+)?
The IUPAC name of 3-trimethylsilyloxyprop-1-enylideneiron(1+) (CID 11050885) is 3-trimethylsilyloxyprop-1-enylideneiron(1+).
What is the SMILES notation for 3-trimethylsilyloxyprop-1-enylideneiron(1+)?
The canonical SMILES for 3-trimethylsilyloxyprop-1-enylideneiron(1+) is C[Si](C)(C)OCC=C=[Fe+].
What is the InChIKey of 3-trimethylsilyloxyprop-1-enylideneiron(1+)?
The InChIKey is QTRDTDUVQWKQGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12OSi.Fe/c1-5-6-7-8(2,3)4;/h5H,6H2,2-4H3;/q;+1.
What are the key properties of 3-trimethylsilyloxyprop-1-enylideneiron(1+)?
3-trimethylsilyloxyprop-1-enylideneiron(1+) has a molecular weight of 184.09 g/mol, XLogP of 1.34, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilyloxyprop-1-enylideneiron(1+) is sourced from PubChem (CID 11050885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).