Carbonylchlorohydridotris(triphenylphosphine)ruthenium(II)

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  • 16971-33-8
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  • Metal purity 99.95
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Catalog Number
ACM16971338-1
Product Name
Carbonylchlorohydridotris(triphenylphosphine)ruthenium(II)
Structure
Structure
CAS
16971-33-8
Category
Ruthenium series catalysts
Synonyms
Carbonylchlorohydridotris(triphenylphosphine)ruthenium(II);16971-33-8;MFCD00049804;Ru(CO)ClH[P(C6H5)3]3;[(C6H5)3P]3Ru(CO)(Cl)H;AKOS024258164;
IUPAC Name
chloro(hydrido)ruthenium;formaldehyde;triphenylphosphane;
Molecular Weight
952.41
Molecular Formula
C55H46ClOP3Ru
Canonical SMILES
C=O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[RuH];
InChI
InChI=1S/3C18H15P.CH₂O.ClH.Ru.H/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;;;/h3*1-15H;1H2;1H;;/q;;;;;+1;/p-1;
InChI Key
IOCHTJOKPQTFJY-UHFFFAOYSA-M;
Appearance
beige
Application
Hydroformylation; Hydrogenation→Transfer Hydrogenation; Isomerization;
Color/Form
powder
Complexity
206
Covalently-Bonded Unit Count
5
EC Number
241-051-0
Exact Mass
954.165g/mol
H-Bond Acceptor
1
Heavy Atom Count
61
Monoisotopic Mass
954.165g/mol
Rotatable Bond Count
9
Topological Polar Surface Area
17.1A^2
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