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Hoveyda-Grubbs Catalyst 1st Generation

CAS No.:
203714-71-0
Catalog Number:
AG003503
Molecular Formula:
C28H45Cl2OPRu
Molecular Weight:
600.6061
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Product Description
Catalog Number:
AG003503
Chemical Name:
Hoveyda-Grubbs Catalyst 1st Generation
CAS Number:
203714-71-0
Molecular Formula:
C28H45Cl2OPRu
Molecular Weight:
600.6061
MDL Number:
MFCD03453042
IUPAC Name:
dichloro-[(2-propan-2-yloxyphenyl)methylidene]ruthenium;tricyclohexylphosphane
InChI:
InChI=1S/C18H33P.C10H12O.2ClH.Ru/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-8(2)11-10-7-5-4-6-9(10)3;;;/h16-18H,1-15H2;3-8H,1-2H3;2*1H;/q;;;;+2/p-2
InChI Key:
KMKCJXPECJFQPQ-UHFFFAOYSA-L
SMILES:
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.CC(Oc1ccccc1C=[Ru](Cl)Cl)C
Properties
Complexity:
404  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
600.163g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
600.611g/mol
Monoisotopic Mass:
600.163g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties