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22594-69-0 molecular structure
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bis(dichlororuthenium); hexakis(methanidylidyneoxidanium)

ChemBase ID: 145881
Molecular Formular: C6Cl4O6Ru2
Molecular Mass: 512.0126
Monoisotopic Mass: 511.65359644
SMILES and InChIs

SMILES:
[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].Cl[Ru]Cl.Cl[Ru]Cl
Canonical SMILES:
Cl[Ru]Cl.Cl[Ru]Cl.[O+]#[C-].[O+]#[C-].[O+]#[C-].[O+]#[C-].[O+]#[C-].[O+]#[C-]
InChI:
InChI=1S/6CO.4ClH.2Ru/c6*1-2;;;;;;/h;;;;;;4*1H;;/q;;;;;;;;;;2*+2/p-4
InChIKey:
JYHHJVKGDCZCCL-UHFFFAOYSA-J

Cite this record

CBID:145881 http://www.chembase.cn/molecule-145881.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
bis(dichlororuthenium); hexakis(methanidylidyneoxidanium)
IUPAC Traditional name
hexakis(carbon monoxide); bis(dichlororuthenium)
Synonyms
CORM-2
Tricarbonyldichlororuthenium(II) dimer
三羰基二氯代钌二聚物
CAS Number
22594-69-0
MDL Number
MFCD00011528
PubChem SID
162240081
24857320
PubChem CID
10951331

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
288144 external link Add to cart Please log in.
Data Source Data ID
PubChem 10951331 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.269  LogD (pH = 7.4) 1.269 
Log P 1.269  Molar Refractivity 12.2726 cm3
Polarizability 9.40066 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
European Hazard Symbols
Harmful Harmful (Xn) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
20/21/22-36/37/38 expand Show data source
Safety Statements
26-37/39 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H302-H312-H315-H319-H332-H335 expand Show data source
GHS Precautionary statements
P261-P280-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Linear Formula
[Ru(CO)3Cl2]2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 288144 external link
Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Packaging
500 mg in glass bottle
Application
Carbon monoxide-releasing molecule used for pharamological studies including:
• Enhancement of coagulation and attenuation of vulnerability to fibrinolysis1
• Investigations of P2X4 as a possible target2
• Possible modification of thrombus growth or disintegration3
• Enhances fibrinogen as a substrate for thrombin4
• Regulation of ion transport by gasotransmitters5Used as a CO donor for reactive oxygen species mediated bacterial killing6

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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