cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium

C10H8Cl2Ru-6 — CID 175094223

IUPACcyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium
SMILESClc1ccc[c-]1Cl.[Ru].[cH-]1[cH-][cH-][cH-][cH-]1
InChIInChI=1S/C5H3Cl2.C5H5.Ru/c6-4-2-1-3-5(4)7;1-2-4-5-3-1;/h1-3H;1-5H;/q-1;-5;
InChIKeyQIZUPOKWKBKFSQ-UHFFFAOYSA-N
MW300.15 g/mol
LogP4.12
Rot. Bonds

About cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium

cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium (PubChem CID 175094223) has the molecular formula C10H8Cl2Ru-6 and a molecular weight of 300.15 g/mol. Its IUPAC name is cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium.

Molecular Properties

Compound Namecyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium
PubChem CID175094223
Molecular FormulaC10H8Cl2Ru-6
Molecular Weight300.15 g/mol
Exact Mass299.91
IUPAC Namecyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium
SMILESClc1ccc[c-]1Cl.[Ru].[cH-]1[cH-][cH-][cH-][cH-]1
InChIInChI=1S/C5H3Cl2.C5H5.Ru/c6-4-2-1-3-5(4)7;1-2-4-5-3-1;/h1-3H;1-5H;/q-1;-5;
InChIKeyQIZUPOKWKBKFSQ-UHFFFAOYSA-N
XLogP4.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.15
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium?
The IUPAC name of cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium (CID 175094223) is cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium.
What is the SMILES notation for cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium?
The canonical SMILES for cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium is Clc1ccc[c-]1Cl.[Ru].[cH-]1[cH-][cH-][cH-][cH-]1.
What is the InChIKey of cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium?
The InChIKey is QIZUPOKWKBKFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3Cl2.C5H5.Ru/c6-4-2-1-3-5(4)7;1-2-4-5-3-1;/h1-3H;1-5H;/q-1;-5;.
What are the key properties of cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium?
cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium has a molecular weight of 300.15 g/mol, XLogP of 4.12, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentane;1,5-dichlorocyclopenta-1,3-diene;ruthenium is sourced from PubChem (CID 175094223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).