9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene

C18H18Si — CID 173209715

IUPAC9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene
SMILESCC1=C2c3c(-c4ccccc4)cccc3C1[Si]2(C)C
InChIInChI=1S/C18H18Si/c1-12-17-15-11-7-10-14(13-8-5-4-6-9-13)16(15)18(12)19(17,2)3/h4-11,17H,1-3H3
InChIKeyVDQJGJGSFOPSTK-UHFFFAOYSA-N
MW262.43 g/mol
LogP5.02
Rot. Bonds1

About 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene

9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene (PubChem CID 173209715) has the molecular formula C18H18Si and a molecular weight of 262.43 g/mol. Its IUPAC name is 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene.

Molecular Properties

Compound Name9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene
PubChem CID173209715
Molecular FormulaC18H18Si
Molecular Weight262.43 g/mol
Exact Mass262.12
IUPAC Name9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene
SMILESCC1=C2c3c(-c4ccccc4)cccc3C1[Si]2(C)C
InChIInChI=1S/C18H18Si/c1-12-17-15-11-7-10-14(13-8-5-4-6-9-13)16(15)18(12)19(17,2)3/h4-11,17H,1-3H3
InChIKeyVDQJGJGSFOPSTK-UHFFFAOYSA-N
XLogP5.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.43
LogP ≤ 55.02
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 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene?
The IUPAC name of 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene (CID 173209715) is 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene.
What is the SMILES notation for 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene?
The canonical SMILES for 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene is CC1=C2c3c(-c4ccccc4)cccc3C1[Si]2(C)C.
What is the InChIKey of 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene?
The InChIKey is VDQJGJGSFOPSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Si/c1-12-17-15-11-7-10-14(13-8-5-4-6-9-13)16(15)18(12)19(17,2)3/h4-11,17H,1-3H3.
What are the key properties of 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene?
9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene has a molecular weight of 262.43 g/mol, XLogP of 5.02, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9,10-trimethyl-3-phenyl-9-silatricyclo[6.1.1.02,7]deca-1(10),2,4,6-tetraene is sourced from PubChem (CID 173209715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).