Dichloro[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene](3-phenyl-1H-inden-1-ylidene)(tricyclohexylphosphine)ruthenium(II)

• CAS: 536724-67-1
• Catalog Number: ACM536724671
• Category: Ruthenium series catalysts
• Molecular Weight: 949.104g/mol
• Molecular Formula: C54H69Cl2N2PRu
• Synonyms: 536724-67-1; Dichloro[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene](3-phenyl-1H-inden-1-ylidene)(tricyclohexylphosphine)ruthenium(II); BCP13985; TRICYCLOHEXYLPHOSPHINE[3-PHENYL-1H-INDEN-1-YLIDENE][1,3-BIS(2,4,6-TRIMETHYLPHENYL)-4,5-DIHYDROIMIDAZOL-2-YLIDENE]RUTHENIUM(II) DICHLORIDE; MFCD08667892; [1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-dichloro-(3-phenylinden-1-ylidene)ruthenium; Neolyst M 2; TRICYCLOHEXYLPHOSPHINE[3-PHENYL-1H-INDEN-1-YLIDENE][1,3-BIS(2,4,6-TRIMETHYLPHENYL)-4,5-DIHYDROIMIDAZOL-2-YLIDENE]RUTHENIUM (II) DICHLORIDE, MIN. 95% NEOLYST M2; AKOS032948007; SCHEMBL2230761
• IUPAC Name: [1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-dichloro-(3-phenylinden-1-ylidene)ruthenium;tricyclohexylphosphane
• Canonical SMILES: CC1=CC(=C(C(=C1)C)N2CCN(C2=[Ru](=C3C=C(C4=CC=CC=C43)C5=CC=CC=C5)(Cl)Cl)C6=C(C=C(C=C6C)C)C)C.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3
• InChI: InChI=1S/C21H26N2.C18H33P.C15H10.2ClH.Ru/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;;;/h9-12H,7-8H2,1-6H3;16-18H,1-15H2;1-9,11H;2*1H;/q;;;;;+2/p-2
• InChI Key: MCNUJWCJGIGFBS-UHFFFAOYSA-L
• Application: Catalyst used for the Atom Transfer Radical Polymerization (ATRP) of vinyl monomers.
• Complexity: 1240
• Covalently-Bonded Unit Count: 2
• Exact Mass: 948.362g/mol
• H-Bond Acceptor: 2
• Heavy Atom Count: 60
• Monoisotopic Mass: 948.362g/mol
• Rotatable Bond Count: 6
• Topological Polar Surface Area: 6.5A^2

Custom Q&A

What is the molecular formula of the compound?

The molecular formula of the compound is C54H69Cl2N2PRu.

What are some synonyms for the compound?

Some synonyms for the compound include Neolyst M 2 and [1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-dichloro-(3-phenylinden-1-ylidene)ruthenium.

What is the molecular weight of the compound?

The molecular weight of the compound is 949.1 g/mol.

How many hydrogen bond acceptor counts does the compound have?

The compound has 2 hydrogen bond acceptor counts.

What is the exact mass of the compound?

The exact mass of the compound is 948.361883 g/mol.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 6.5 ².

How many heavy atoms are present in the compound?

There are 60 heavy atoms present in the compound.

What is the formal charge of the compound?

The formal charge of the compound is 0.

How many covalently-bonded unit counts are present in the compound?

There are 2 covalently-bonded unit counts in the compound.

Does the compound have any defined or undefined atom or bond stereocenters?

No, the compound does not have any defined or undefined atom or bond stereocenters.