3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene

C16H24Si — CID 618506

IUPAC3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene
SMILESCCC1=C(C)[Si]2(C(C)=C1)C(C)=CC(CC)=C2C
InChIInChI=1S/C16H24Si/c1-7-15-9-11(3)17(13(15)5)12(4)10-16(8-2)14(17)6/h9-10H,7-8H2,1-6H3
InChIKeyPHJBFGIPQCTNCS-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.96
Rot. Bonds2

About 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene

3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene (PubChem CID 618506) has the molecular formula C16H24Si and a molecular weight of 244.45 g/mol. Its IUPAC name is 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene.

Molecular Properties

Compound Name3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene
PubChem CID618506
Molecular FormulaC16H24Si
Molecular Weight244.45 g/mol
Exact Mass244.16
IUPAC Name3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene
SMILESCCC1=C(C)[Si]2(C(C)=C1)C(C)=CC(CC)=C2C
InChIInChI=1S/C16H24Si/c1-7-15-9-11(3)17(13(15)5)12(4)10-16(8-2)14(17)6/h9-10H,7-8H2,1-6H3
InChIKeyPHJBFGIPQCTNCS-UHFFFAOYSA-N
XLogP4.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene?
The IUPAC name of 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene (CID 618506) is 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene.
What is the SMILES notation for 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene?
The canonical SMILES for 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene is CCC1=C(C)[Si]2(C(C)=C1)C(C)=CC(CC)=C2C.
What is the InChIKey of 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene?
The InChIKey is PHJBFGIPQCTNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24Si/c1-7-15-9-11(3)17(13(15)5)12(4)10-16(8-2)14(17)6/h9-10H,7-8H2,1-6H3.
What are the key properties of 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene?
3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene has a molecular weight of 244.45 g/mol, XLogP of 4.96, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-diethyl-1,4,6,9-tetramethyl-5-silaspiro[4.4]nona-1,3,6,8-tetraene is sourced from PubChem (CID 618506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).