CAS 944451-32-5

[1,1′-(4R)-[4,4′-Bi-1,3-benzodioxole]-5,5′-diylbis[1,1-bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]phosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]ruthenium

Description:

The chemical substance with the name "[1,1′-(4R)-[4,4′-Bi-1,3-benzodioxole]-5,5′-diylbis[1,1-bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]phosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]ruthenium" and CAS number "944451-32-5" is a complex organometallic compound featuring a ruthenium center coordinated with various ligands. This compound is characterized by its intricate structure, which includes multiple phosphine ligands that enhance its stability and reactivity. The presence of the bi-benzodioxole moiety contributes to its unique electronic properties, potentially influencing its catalytic activity. The dichloro groups indicate that it may participate in substitution reactions, making it useful in various chemical transformations. Additionally, the bulky tert-butyl groups attached to the phenyl rings can provide steric hindrance, which may affect the compound's reactivity and selectivity in catalytic processes. Overall, this compound exemplifies the complexity and versatility of organometallic chemistry, particularly in the context of catalysis and materials science.

Formula: C₈₄H₁₁₄Cl₂O₈P₂Ru

InChI: InChI=1S/C74H100O8P2.C10H14.2ClH.Ru/c1-67(2,3)47-33-43(34-48(61(47)75-25)68(4,5)6)83(44-35-49(69(7,8)9)62(76-26)50(36-44)70(10,11)12)57-31-29-55-65(81-41-79-55)59(57)60-58(32-30-56-66(60)82-42-80-56)84(45-37-51(71(13,14)15)63(77-27)52(38-45)72(16,17)18)46-39-53(73(19,20)21)64(78-28)54(40-46)74(22,23)24;1-8(2)10-6-4-9(3)5-7-10;;;/h29-40H,41-42H2,1-28H3;4-8H,1-3H3;2*1H;/q;;;;+2/p-2

InChI key: InChIKey=MYYXUILRYSITRR-UHFFFAOYSA-L

SMILES: [Cl-][Ru+2]123456([Cl-])(C=7(C(C)C)[CH]1=[CH]2C3(C)=[CH]4[CH]57)[P](C=8C(C=9C([P]6(C%10=CC(C(C)(C)C)=C(OC)C(C(C)(C)C)=C%10)C%11=CC(C(C)(C)C)=C(OC)C(C(C)(C)C)=C%11)=CC=C%12C9OCO%12)=C%13C(=CC8)OCO%13)(C%14=CC(C(C)(C)C)=C(OC)C(C(C)(C)C)=C%14)C%15=CC(C(C)(C)C)=C(OC)C(C(C)(C)C)=C%15

Synonyms:

• Ruthenium, [1,1′-(4R)-[4,4′-bi-1,3-benzodioxole]-5,5′-diylbis[1,1-bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]phosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]-
• [1,1′-(4R)-[4,4′-Bi-1,3-benzodioxole]-5,5′-diylbis[1,1-bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]phosphine-κP]]dichloro[(1,2,3,4,5,6-η)-1-methyl-4-(1-methylethyl)benzene]ruthenium
• Chloro{(R)-(-)-5,5'-bis[di(3,5-di-t-butyl-4-methoxyphenyl)phosphino]-4,4'-bi-1,3-benzodioxole}(p-cymene)ruthenium(II)chloride[RuCl(p-cymene) ((R)-dtbm-segphos)]Cl
• [RuCl(p-cymene)((R)-dtbm-segphos(regR))]Cl
• (R)-RuCl[(p-cyMene)(DTBM-SEGPHOS)]Cl
• [RUCL(P-CYMENE)((R)-DTBM-SEGPHOS)]CL
• e}(p-cymene)ruthenium(II) chL
• Chloro{(R)-(-)-5,5'-bis[di(3,5-di-t-butyl-4-methoxyphenyl)phosphino]-4,4'-bi-1,3-benzodioxole}(p-cymene)ruthenium(II) chloride [RuCl(p-cymene)((R)-dtbm-segphos(R))]Cl
• [RuCl(p-cymene)((R)-dtbm-segphos[R])]Cl
• [RuCl(p-cymene)((R)-dtbm-segphos(regR))]Cl [RuCl(p-cymene)((R)-dtbm-segphos)]Cl
• oro{(R)-(-)-5,5''-bis[di(3,5-di-t-butyL

[RuCl(p-cymene)((R)-dtbm-segphos®)]Cl

CAS: 944451-32-5

Formula: C₈₄H₁₁₄Cl₂O₈P₂Ru

Color and Shape: Light yellow to Amber to Dark green powder to crystal

Molecular weight: 1,485.75

Ref: 3B-R0158

Chloro{(R)-(-)-5,5'-bis[di(3,5-di-t-butyl-4-methoxyphenyl)phosphino]-4,4'-bi-1,3-benzodioxole}(p-cymene)ruthenium(II) chloride

CAS: 944451-32-5

Formula: C₈₄H₁₁₄Cl₂O₈P₂Ru

Purity: 97%

Color and Shape: Solid

Molecular weight: 1485.7227

Ref: IN-DA003CBZ

Chloro{(R)-(-)-5,5'-bis[di(3,5-di-t-butyl-4-methoxyphenyl)phosphino]-4,4'-bi-1,3-benzodioxole}(p-cymene)ruthenium(II) chloride [RuCl(p-cymene)((R)-dtbm-segphos®)]Cl

CAS: 944451-32-5

Chloro{(R)-(-)-5,5'-bis[di(3,5-di-t-butyl-4-methoxyphenyl)phosphino]-4,4'-bi-1,3-benzodioxole}(p-cymene)ruthenium(II) chloride [RuCl(p-cymene)((R)-dtbm-segphos®)]Cl

Formula: C₈₄H₁₁₄ClO₈P₂RuCl

Color and Shape: yellow to dark brown pwdr.

Molecular weight: 1485.72

Ref: 08-44-0102