Dichloro(p-cymene)ruthenium(II) dimer

Catalog Number	ACM52462290-1
CAS	52462-29-0
Structure
Synonyms	Bis(p-cymene)diruthenium(II) tetrachloride-di-mu-chlorobis[(p-cymene)chlororuthenium(II)]
IUPAC Name	dichlororuthenium;1-methyl-4-propan-2-ylbenzene;
Molecular Weight	612.39
Molecular Formula	C20H28Cl4Ru2
Canonical SMILES	CC1=CC=C(C=C1)C(C)C.CC1=CC=C(C=C1)C(C)C.Cl[Ru]Cl.Cl[Ru]Cl
InChI	InChI=1S/2C10H14.4ClH.2Ru/c2*1-8(2)10-6-4-9(3)5-7-10;/h2*4-8H,1-3H3;4*1H;/q;2*+2/p-4
InChI Key	LAXRNWSASWOFOT-UHFFFAOYSA-J
Melting Point	247-250 °C
Purity	99%
Appearance	Orange red crystalline powder
Application	Hydrosilylation Catalysts Umicore Precatalysts for Asymmetric and Cross-Coupling Catalysis Cyclometalated ruthenium complexes with arylimines and nitrogen-containing heterocycles via C-H bond activation
Complexity	89
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
EC Number	435-530-5
Exact Mass	615.90133
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Monoisotopic Mass	611.903192
Rotatable Bond Count	2
Topological Polar Surface Area	0 Ų

Q&A

What is the molecular formula of Dichloro(p-cymene)ruthenium(II) dimer?

The molecular formula of Dichloro(p-cymene)ruthenium(II) dimer is C20H28Cl4Ru2.

What is the molecular weight of Dichloro(p-cymene)ruthenium(II) dimer?

The molecular weight of Dichloro(p-cymene)ruthenium(II) dimer is 612.4 g/mol.

What are the component compounds of Dichloro(p-cymene)ruthenium(II) dimer?

The component compounds are Ruthenium dichloride and p-CYMENE.

What is the IUPAC name of Dichloro(p-cymene)ruthenium(II) dimer?

The IUPAC name is dichlororuthenium;1-methyl-4-propan-2-ylbenzene.

What is the InChIKey of Dichloro(p-cymene)ruthenium(II) dimer?

The InChIKey is LAXRNWSASWOFOT-UHFFFAOYSA-J.

What is the Canonical SMILES representation of Dichloro(p-cymene)ruthenium(II) dimer?

The Canonical SMILES representation is CC1=CC=C(C=C1)C(C)C.CC1=CC=C(C=C1)C(C)C.Cl[Ru]Cl.Cl[Ru]Cl.

What is the CAS number of Dichloro(p-cymene)ruthenium(II) dimer?

The CAS number is 52462-29-0.

How many hydrogen bond donor counts does Dichloro(p-cymene)ruthenium(II) dimer have?

It has 0 hydrogen bond donor counts.

What is the topological polar surface area of Dichloro(p-cymene)ruthenium(II) dimer?

The topological polar surface area is 0?2.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the molecular weight of the compound?

The molecular weight is 612.4 g/mol.

What are some synonyms for Dichloro(p-cymene)ruthenium(II) Dimer?

Some synonyms include dichlororuthenium;1-methyl-4-propan-2-ylbenzene and [rucl2(p-cymene)]2.

When was the compound created and last modified in the database?

It was created on 2006-10-26 and last modified on 2023-12-30.

What is the InChIKey of the compound?

The InChIKey is LAXRNWSASWOFOT-UHFFFAOYSA-J.

What is the CAS number for Dichloro(p-cymene)ruthenium(II) Dimer?

The CAS number is 52462-29-0.

How many hydrogen bond donor counts are there in the compound?

There are 0 hydrogen bond donor counts.

What is the exact mass and monoisotopic mass of the compound?

The exact mass is 615.90133 g/mol, and the monoisotopic mass is 611.903192 g/mol.