(S)-(+)-N,N-Dimethyl-1-[(R)-2-(diphenylphosphino)ferrocenyl]ethylamine
Basic information
- CAS
55650-58-3- Standard SMILES
C[C@@H]([C]1C=CC=C1P(c1ccccc1)c1ccccc1)N(C)C.[CH]1C=CC=C1.[Fe]- InChIKey
RCAFPSZHKFOLEE-RMRYJAPISA-N- Molecular formula
- C26H28FeNP
- Average molar mass
- 441.3 g/mol
- Monoisotopic mass
- 441.130872
Names & identifiers
- Preferred name
- (S)-(+)-N,N-Dimethyl-1-[(R)-2-(diphenylphosphino)ferrocenyl]ethylamine
- English name
- (S)-N,N-Dimethyl-1-[(R)-2-(diphenylphosphino)ferrocenyl]ethylamine
- Molecular formula
- C26H28FeNP10*
- Molecular weight
- 441.33
Names & synonyms
(S)-(+)-N,N-Dimethyl-1-((R)-2-(diphenylphosphino)ferrocenyl)ethylamine(S)-(+)-N,N-DIMETHYL-1-[(R)-2-(DIPHENYLPHOSPHINO)FERROCENYL]ETHYLAMINERefChem:407636678-897-955650-58-3C26H28FeNP(s)-ppfaAKOS007929959(S)-(+)-N,N-Dimethyl-1-(2-diphenylphosphino)ferrocenylethyla(S)-(R)-PPFAJosiphos SL-0000-1(S)-(+)-N,N-DIMETHYL-1-(2-DIPHENYLP
Show more names
(S,R)-1-(1-dimethylaminoethyl)-2-*(diphenylphosph(+)-(S)-N,N-dimethyl-1-((R)-2-(diphenyl-phosphino(+)-(S)-N,N-dimethyl-1-((R)-2-(diphenyl-phosphino(S)-(+)-N,N-DIMETHYL-1-(2-DIPHENYLPHOSPHINO)FERROCENYLETHYLAMINE1(S)-[1(R)-(DIMETHYLAMINO)ETHYL]-2-(DIPHENYL-PHOSPHANY)FERROCENE(+)-(S)-N,N-DIMETHYL-1-[(R)-2(DIPHENYLPHOSPHINO)FERROCENYL]ETHYL
Database identifiers
- CAS
55650-58-3- PubChem CID
- 56587680
- EC Number
- 678-897-9
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 447
Physicochemical properties
- Melting point
- 141 · 141-143°C
- alpha
- 355 · 355 º (C=0.6 IN ETOH)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- form
- solid
- color
- Light yellow to Brown
- Water Solubility
- Insoluble in water.
- Sensitive
- Air Sensitive
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Warning
- Hazard statements
- 301 · H301-H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P301+P310a-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi,Xn
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 22 · 22-26-36/37/39-36
- RIDADR
- 3288 · 3288
- Hazard Note
- Irritant/Air Sensitive
- HazardClass
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- ridadr
- 3288
- hs_code
- 2931499090
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS06
- hazard_code
- Xi,Xn
- hazard_note
- Irritant/Air Sensitive
- safety_code
- 22-26-36/37/39-36
- hazard_class
- 6.1
- packing_group
- III
- Hazard statements
- H301-H315-H319-H335
- Precautionary statements
- P261-P280a-P301+P310a-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
Uses(S)-(+)-N,N-Dimethyl-1-[(R)-2-(diphenylphosphino)ferrocenyl]ethylamine is the raw material of asymmetric hydrogenation chiral ligands.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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