trichlororuthenium;1,3,5-trimethylbenzene

C9H12Cl3Ru — CID 175712088

IUPACtrichlororuthenium;1,3,5-trimethylbenzene
SMILESCc1cc(C)cc(C)c1.Cl[Ru](Cl)Cl
InChIInChI=1S/C9H12.3ClH.Ru/c1-7-4-8(2)6-9(3)5-7;;;;/h4-6H,1-3H3;3*1H;/q;;;;+3/p-3
InChIKeyZPIKKKWOVKRELW-UHFFFAOYSA-K
MW327.62 g/mol
LogP4.68
Rot. Bonds

About trichlororuthenium;1,3,5-trimethylbenzene

trichlororuthenium;1,3,5-trimethylbenzene (PubChem CID 175712088) has the molecular formula C9H12Cl3Ru and a molecular weight of 327.62 g/mol. Its IUPAC name is trichlororuthenium;1,3,5-trimethylbenzene.

Molecular Properties

Compound Nametrichlororuthenium;1,3,5-trimethylbenzene
PubChem CID175712088
Molecular FormulaC9H12Cl3Ru
Molecular Weight327.62 g/mol
Exact Mass326.90
IUPAC Nametrichlororuthenium;1,3,5-trimethylbenzene
SMILESCc1cc(C)cc(C)c1.Cl[Ru](Cl)Cl
InChIInChI=1S/C9H12.3ClH.Ru/c1-7-4-8(2)6-9(3)5-7;;;;/h4-6H,1-3H3;3*1H;/q;;;;+3/p-3
InChIKeyZPIKKKWOVKRELW-UHFFFAOYSA-K
XLogP4.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.62
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of trichlororuthenium;1,3,5-trimethylbenzene?
The IUPAC name of trichlororuthenium;1,3,5-trimethylbenzene (CID 175712088) is trichlororuthenium;1,3,5-trimethylbenzene.
What is the SMILES notation for trichlororuthenium;1,3,5-trimethylbenzene?
The canonical SMILES for trichlororuthenium;1,3,5-trimethylbenzene is Cc1cc(C)cc(C)c1.Cl[Ru](Cl)Cl.
What is the InChIKey of trichlororuthenium;1,3,5-trimethylbenzene?
The InChIKey is ZPIKKKWOVKRELW-UHFFFAOYSA-K. The full InChI is InChI=1S/C9H12.3ClH.Ru/c1-7-4-8(2)6-9(3)5-7;;;;/h4-6H,1-3H3;3*1H;/q;;;;+3/p-3.
What are the key properties of trichlororuthenium;1,3,5-trimethylbenzene?
trichlororuthenium;1,3,5-trimethylbenzene has a molecular weight of 327.62 g/mol, XLogP of 4.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichlororuthenium;1,3,5-trimethylbenzene is sourced from PubChem (CID 175712088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).