[(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane

C12H21FSi — CID 174029667

IUPAC[(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane
SMILESC=C(/C=C\C(C)=C(/F)CC)[Si](C)(C)C
InChIInChI=1S/C12H21FSi/c1-7-12(13)10(2)8-9-11(3)14(4,5)6/h8-9H,3,7H2,1-2,4-6H3/b9-8-,12-10-
InChIKeyRAGBELKLEYNTIT-DMGFJBLZSA-N
MW212.38 g/mol
LogP4.63
Rot. Bonds4

About [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane

[(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane (PubChem CID 174029667) has the molecular formula C12H21FSi and a molecular weight of 212.38 g/mol. Its IUPAC name is [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane.

Molecular Properties

Compound Name[(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane
PubChem CID174029667
Molecular FormulaC12H21FSi
Molecular Weight212.38 g/mol
Exact Mass212.14
IUPAC Name[(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane
SMILESC=C(/C=C\C(C)=C(/F)CC)[Si](C)(C)C
InChIInChI=1S/C12H21FSi/c1-7-12(13)10(2)8-9-11(3)14(4,5)6/h8-9H,3,7H2,1-2,4-6H3/b9-8-,12-10-
InChIKeyRAGBELKLEYNTIT-DMGFJBLZSA-N
XLogP4.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane?
The IUPAC name of [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane (CID 174029667) is [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane.
What is the SMILES notation for [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane?
The canonical SMILES for [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane is C=C(/C=C\C(C)=C(/F)CC)[Si](C)(C)C.
What is the InChIKey of [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane?
The InChIKey is RAGBELKLEYNTIT-DMGFJBLZSA-N. The full InChI is InChI=1S/C12H21FSi/c1-7-12(13)10(2)8-9-11(3)14(4,5)6/h8-9H,3,7H2,1-2,4-6H3/b9-8-,12-10-.
What are the key properties of [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane?
[(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane has a molecular weight of 212.38 g/mol, XLogP of 4.63, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3Z,5Z)-6-fluoro-5-methylocta-1,3,5-trien-2-yl]-trimethylsilane is sourced from PubChem (CID 174029667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).