trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane

C24H25Cl3Si — CID 154420962

IUPACtrichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane
SMILESCC(CCCC[Si](Cl)(Cl)Cl)(C1C=CC=C1)C1c2ccccc2-c2ccccc21
InChIInChI=1S/C24H25Cl3Si/c1-24(18-10-2-3-11-18,16-8-9-17-28(25,26)27)23-21-14-6-4-12-19(21)20-13-5-7-15-22(20)23/h2-7,10-15,18,23H,8-9,16-17H2,1H3
InChIKeyDRGSPRSOZRWLHT-UHFFFAOYSA-N
MW447.91 g/mol
LogP8.37
Rot. Bonds7

About trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane

trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane (PubChem CID 154420962) has the molecular formula C24H25Cl3Si and a molecular weight of 447.91 g/mol. Its IUPAC name is trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane.

Molecular Properties

Compound Nametrichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane
PubChem CID154420962
Molecular FormulaC24H25Cl3Si
Molecular Weight447.91 g/mol
Exact Mass446.08
IUPAC Nametrichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane
SMILESCC(CCCC[Si](Cl)(Cl)Cl)(C1C=CC=C1)C1c2ccccc2-c2ccccc21
InChIInChI=1S/C24H25Cl3Si/c1-24(18-10-2-3-11-18,16-8-9-17-28(25,26)27)23-21-14-6-4-12-19(21)20-13-5-7-15-22(20)23/h2-7,10-15,18,23H,8-9,16-17H2,1H3
InChIKeyDRGSPRSOZRWLHT-UHFFFAOYSA-N
XLogP8.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.91
LogP ≤ 58.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9-(2-cyclopenta-2,4-dien-1-ylhex-5-en-2-yl)-9H-fluorene;titanium(2+);dichloride
CID 161408642
9-(2-cyclopenta-2,4-dien-1-ylpent-4-en-2-yl)-9H-fluorene
CID 11385650
9-[2-(9H-fluoren-9-yl)propan-2-yl]-9H-fluorene
CID 22619280
9-[bis(4-chlorophenyl)-cyclopenta-2,4-dien-1-ylmethyl]-9H-fluorene
CID 101371835
4,4-di(cyclopenta-2,4-dien-1-yl)pentoxy-triphenylsilane
CID 86212953
chloro-cyclopenta-2,4-dien-1-yl-(9H-fluoren-9-yl)-methylsilane
CID 154420413
9-(3-cyclopenta-2,4-dien-1-yl-2-methylhept-6-en-3-yl)-9H-fluorene
CID 159062487
carbanide;cyclopenta-2,4-dien-1-yl-(9H-fluoren-9-yl)-methyl-[6-[(2-methylpropan-2-yl)oxy]hexyl]silane;dichlorozirconium(2+)
CID 159748009
9-(1-chloro-1-phenylethyl)-9H-fluorene
CID 18987529
9-[2-(2,3,3a,7a-tetrahydro-1H-inden-1-yl)propan-2-yl]-9H-fluorene
CID 140872855
9-(2-cyclopenta-1,3-dien-1-ylhexan-2-yl)-9H-fluorene;dihydrochloride
CID 174295322
9-[2-(3-tert-butylcyclopenta-2,4-dien-1-yl)propan-2-yl]-9H-fluorene
CID 100964973

Frequently Asked Questions

What is the IUPAC name of trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane?
The IUPAC name of trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane (CID 154420962) is trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane.
What is the SMILES notation for trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane?
The canonical SMILES for trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane is CC(CCCC[Si](Cl)(Cl)Cl)(C1C=CC=C1)C1c2ccccc2-c2ccccc21.
What is the InChIKey of trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane?
The InChIKey is DRGSPRSOZRWLHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25Cl3Si/c1-24(18-10-2-3-11-18,16-8-9-17-28(25,26)27)23-21-14-6-4-12-19(21)20-13-5-7-15-22(20)23/h2-7,10-15,18,23H,8-9,16-17H2,1H3.
What are the key properties of trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane?
trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane has a molecular weight of 447.91 g/mol, XLogP of 8.37, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-[5-cyclopenta-2,4-dien-1-yl-5-(9H-fluoren-9-yl)hexyl]silane is sourced from PubChem (CID 154420962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).