Basic information
- CAS
944450-46-8- Standard SMILES
Cc1cc(C)cc(P(c2cc(C)cc(C)c2)c2ccc3c(c2-c2c(P(c4cc(C)cc(C)c4)c4cc(C)cc(C)c4)ccc4c2OCO4)OCO3)c1.NC(c1ccccc1)C(N)c1ccccc1.[Cl][Ru][Cl]- InChIKey
FOEKPXQPRAIJRW-UHFFFAOYSA-L- Molecular formula
- C60H60Cl2N2O4P2Ru
- Average molar mass
- 1,107 g/mol
- Monoisotopic mass
- 1,106.244878
Overview
See also: RuCl2((R)-dm-segphos(regR))((R,R)-dpen) (annotation moved to); RuCl2[(S)-dm-segphos(regR)][(S,S)-dpen] (annotation moved to).
Names & identifiers
- Preferred name
- RuCl2[(S)-dm-segphos(R)][(S,S)-dpen]
- IUPAC
- [4-[5-bis(3,5-dimethylphenyl)phosphanyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphane;dichlororuthenium;1,2-diphenylethane-1,2-diamine
- English name
- Dichloro{(S)-(-)-5,5'-bis[di(3,5-xylyl)phosphino]-4,4'-bi-1,3-benzodioxole} [(1S,2S)-(-)-1,2-diphenylethylenediamine]ruthenium(II) RuCl2[(S)-dm-segphos][(S,S)-dpen]
- Molecular formula
- C60H60Cl2N2O4P2Ru
- Molecular weight
- 1107.052922
Names & synonyms
944450-46-8944450-45-7RuCl2[(S)-(DM-SEGPHOS(R))][(S,S)-DPEN]RuCl2[(R)-(DM-SEGPHOS)][(R,(R))-(DPEN)]RUCL2[(R)-(DM-SEGPHOS(R))][(R,(R))-(DPEN)]RuCl2[(S)-dm-segphos(R)][(S,S)-dpen]CID 71310551RuCl[(S)-dm-segphos][(S,S)-dpen]RuCl2[(S)-(DM-SEGPHOS)][(S,S)-DPEN]RuCl2[(S)-dm-segphos(regR)][(S,S)-dpen]RuCl2[(S)-dm-segphos(regR)][(S,S)-dpen] RuCl2[(S)-dm-segphos][(S,S)-dpen]RuCl2[(S)-(DM-SEGPHOS?)][(S,S)-DPEN]
Show more names
Dichloro[(S)-5,5′-bis[di(3,5-xylyl)phosphino]-4,4′-bi-1,3-benzodioxole][(1S,2S)-1,2-diphenylethylenediamine]ruthenium(II), CAS 944450-46-8Dichloro{(S)-(-)-5,5'-bis[di(3,5-xylyl)phosphino]-4,4'-bi-1,3-benzodioxole} [(1S,2S)-(-)-1,2-diphenylethylenediamine]ruthenium(II) RuCl2[(S)-dm-segphos][(S,S)-dpen]Dichloro{(S)-(-)-5,5'-bis[di(3,5-xylyl)phosphino]-4,4'-bi-1,3-benzodioxole}[(1S,2S)-(-)-1,2-diphenylethylenediamine]ruthenium(II) RuCl2[(S)-dm-segphos(R)][(S,S)-dpen]
Properties
Computed structural properties
- Topological polar surface area
- 89 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 71
- Formal charge
- 0
- Complexity
- 1,160
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- form
- Powder
- color
- yellow
- Sensitive
- air sensitive
- InChIKey
- FOEKPXQPRAIJRW-LISIALKWSA-L
- SMILES
- Cl[Ru]Cl.N[C@H]([C@@H](N)c1ccccc1)c2ccccc2.Cc3cc(C)cc(c3)P(c4cc(C)cc(C)c4)c5ccc6OCOc6c5-c7c8OCOc8ccc7P(c9cc(C)cc(C)c9)c%10cc(C)cc(C)c%10
- UNSPSC Code
- 12352005 · 12352005
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Danger
- Hazard statements
- 360 · H360-H373-H371
- Precautionary statements
- 260 · P260-P314-P501-P260-P264-P270-P309+P311-P405-P501
- WGK Germany
- 3 · 3
- HS Code
- 2843.9 · 2843.90.0000
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- hs_code
- 2843.90.0000
- Signal word
- Danger
- Symbol(GHS)
- GHS08
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H360-H373-H371
- Precautionary statements
- P260-P314-P501-P260-P264-P270-P309+P311-P405-P501
Chemistry & industry
Applications
UsesTakasago Ligands and Complexes for Asymmetric Reactions
Suppliers22 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
绍兴赜军生物医药科技有限公司0575-82126188 15395856318 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
郑州金一化工科技有限公司0371-65511006 18625597674 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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