dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane

C19H25Cl2Si2Zr- — CID 154481762

IUPACdichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane
SMILESC[Si](C)(C)c1ccc2c(c1)[cH-]c1cc([Si](C)(C)C)ccc12.Cl[Zr]Cl
InChIInChI=1S/C19H25Si2.2ClH.Zr/c1-20(2,3)16-7-9-18-14(12-16)11-15-13-17(21(4,5)6)8-10-19(15)18;;;/h7-13H,1-6H3;2*1H;/q-1;;;+2/p-2
InChIKeyDUEAENSIYKWQQR-UHFFFAOYSA-L
MW471.71 g/mol
LogP6.18
Rot. Bonds2

About dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane

dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane (PubChem CID 154481762) has the molecular formula C19H25Cl2Si2Zr- and a molecular weight of 471.71 g/mol. Its IUPAC name is dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane.

Molecular Properties

Compound Namedichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane
PubChem CID154481762
Molecular FormulaC19H25Cl2Si2Zr-
Molecular Weight471.71 g/mol
Exact Mass468.99
IUPAC Namedichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane
SMILESC[Si](C)(C)c1ccc2c(c1)[cH-]c1cc([Si](C)(C)C)ccc12.Cl[Zr]Cl
InChIInChI=1S/C19H25Si2.2ClH.Zr/c1-20(2,3)16-7-9-18-14(12-16)11-15-13-17(21(4,5)6)8-10-19(15)18;;;/h7-13H,1-6H3;2*1H;/q-1;;;+2/p-2
InChIKeyDUEAENSIYKWQQR-UHFFFAOYSA-L
XLogP6.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.71
LogP ≤ 56.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane?
The IUPAC name of dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane (CID 154481762) is dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane.
What is the SMILES notation for dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane?
The canonical SMILES for dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane is C[Si](C)(C)c1ccc2c(c1)[cH-]c1cc([Si](C)(C)C)ccc12.Cl[Zr]Cl.
What is the InChIKey of dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane?
The InChIKey is DUEAENSIYKWQQR-UHFFFAOYSA-L. The full InChI is InChI=1S/C19H25Si2.2ClH.Zr/c1-20(2,3)16-7-9-18-14(12-16)11-15-13-17(21(4,5)6)8-10-19(15)18;;;/h7-13H,1-6H3;2*1H;/q-1;;;+2/p-2.
What are the key properties of dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane?
dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane has a molecular weight of 471.71 g/mol, XLogP of 6.18, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorozirconium;trimethyl-(7-trimethylsilyl-9H-fluoren-9-id-2-yl)silane is sourced from PubChem (CID 154481762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).