[5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane

C33H38OSi — CID 10743291

IUPAC[5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC1=C(C2=CCc3c4c(c5c(c32)CCC5)CCC4)Cc2c3c(c4c(c21)CCC4)CCC3
InChIInChI=1S/C33H38OSi/c1-35(2,3)34-33-30(18-29-24-13-5-9-20(24)22-12-7-15-26(22)32(29)33)28-17-16-27-23-10-4-8-19(23)21-11-6-14-25(21)31(27)28/h17H,4-16,18H2,1-3H3
InChIKeyDISVKZJGXYDHOS-UHFFFAOYSA-N
MW478.75 g/mol
LogP7.40
Rot. Bonds3

About [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane

[5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane (PubChem CID 10743291) has the molecular formula C33H38OSi and a molecular weight of 478.75 g/mol. Its IUPAC name is [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane
PubChem CID10743291
Molecular FormulaC33H38OSi
Molecular Weight478.75 g/mol
Exact Mass478.27
IUPAC Name[5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC1=C(C2=CCc3c4c(c5c(c32)CCC5)CCC4)Cc2c3c(c4c(c21)CCC4)CCC3
InChIInChI=1S/C33H38OSi/c1-35(2,3)34-33-30(18-29-24-13-5-9-20(24)22-12-7-15-26(22)32(29)33)28-17-16-27-23-10-4-8-19(23)21-11-6-14-25(21)31(27)28/h17H,4-16,18H2,1-3H3
InChIKeyDISVKZJGXYDHOS-UHFFFAOYSA-N
XLogP7.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.75
LogP ≤ 57.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane with MolForge

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Frequently Asked Questions

What is the IUPAC name of [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane?
The IUPAC name of [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane (CID 10743291) is [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane.
What is the SMILES notation for [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane?
The canonical SMILES for [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane is C[Si](C)(C)OC1=C(C2=CCc3c4c(c5c(c32)CCC5)CCC4)Cc2c3c(c4c(c21)CCC4)CCC3.
What is the InChIKey of [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane?
The InChIKey is DISVKZJGXYDHOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H38OSi/c1-35(2,3)34-33-30(18-29-24-13-5-9-20(24)22-12-7-15-26(22)32(29)33)28-17-16-27-23-10-4-8-19(23)21-11-6-14-25(21)31(27)28/h17H,4-16,18H2,1-3H3.
What are the key properties of [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane?
[5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane has a molecular weight of 478.75 g/mol, XLogP of 7.40, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl)-2,3,4,7,8,9-hexahydro-1H-cyclopenta[e]-as-indacen-6-yl]oxy-trimethylsilane is sourced from PubChem (CID 10743291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).