1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole

C13H20I2Si — CID 10961505

IUPAC1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole
SMILESCC(C)[Si]1(C(C)C)C(I)=C2CCCC2=C1I
InChIInChI=1S/C13H20I2Si/c1-8(2)16(9(3)4)12(14)10-6-5-7-11(10)13(16)15/h8-9H,5-7H2,1-4H3
InChIKeyRYWGXFDXBRCPIK-UHFFFAOYSA-N
MW458.20 g/mol
LogP5.91
Rot. Bonds2

About 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole

1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole (PubChem CID 10961505) has the molecular formula C13H20I2Si and a molecular weight of 458.20 g/mol. Its IUPAC name is 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole.

Molecular Properties

Compound Name1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole
PubChem CID10961505
Molecular FormulaC13H20I2Si
Molecular Weight458.20 g/mol
Exact Mass457.94
IUPAC Name1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole
SMILESCC(C)[Si]1(C(C)C)C(I)=C2CCCC2=C1I
InChIInChI=1S/C13H20I2Si/c1-8(2)16(9(3)4)12(14)10-6-5-7-11(10)13(16)15/h8-9H,5-7H2,1-4H3
InChIKeyRYWGXFDXBRCPIK-UHFFFAOYSA-N
XLogP5.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.20
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(Z)-iodo-[(2Z)-2-[iodo(trimethylsilyl)methylidene]cyclopentylidene]methyl]-trimethylsilane
CID 11027370
tributyl-[3-iodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silol-1-yl]stannane
CID 11828272
1,3-diiodo-2,2-dimethyl-5,6-dihydro-4H-cyclopenta[c]silole
CID 100919375
2,2-diethyl-1,3-diiodo-5,6-dihydro-4H-cyclopenta[c]silole
CID 100919377
[(E)-iodo-[(2Z)-2-[iodo(trimethylsilyl)methylidene]cyclopentylidene]methyl]-trimethylsilane
CID 177403379

Frequently Asked Questions

What is the IUPAC name of 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole?
The IUPAC name of 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole (CID 10961505) is 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole.
What is the SMILES notation for 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole?
The canonical SMILES for 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole is CC(C)[Si]1(C(C)C)C(I)=C2CCCC2=C1I.
What is the InChIKey of 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole?
The InChIKey is RYWGXFDXBRCPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20I2Si/c1-8(2)16(9(3)4)12(14)10-6-5-7-11(10)13(16)15/h8-9H,5-7H2,1-4H3.
What are the key properties of 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole?
1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole has a molecular weight of 458.20 g/mol, XLogP of 5.91, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diiodo-2,2-di(propan-2-yl)-5,6-dihydro-4H-cyclopenta[c]silole is sourced from PubChem (CID 10961505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).