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692794

(S,S)-DACH-phenyl Trost ligand

95%

Synonym(s):

(1S,2S)-(–)-1,2-Diaminocyclohexane-N,N′-bis(2-diphenylphosphinobenzoyl)

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About This Item

Empirical Formula (Hill Notation):
C44H40N2O2P2
CAS Number:
169689-05-8
Molecular Weight:
690.75
NACRES:
NA.06
PubChem Substance ID:
329761528
UNSPSC Code:
12352002
MDL number:
MFCD01631274
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Quality Segment

assay

95%

form

solid

optical activity

[α]20/D -134°, c = 1 in methanol

manufacturer/tradename

ECACC

mp

136-142 °C

functional group

amide, phosphine

SMILES string

O=C(N[C@H]1CCCC[C@@H]1NC(=O)c2ccccc2P(c3ccccc3)c4ccccc4)c5ccccc5P(c6ccccc6)c7ccccc7

InChI

1S/C44H40N2O2P2/c47-43(37-27-13-17-31-41(37)49(33-19-5-1-6-20-33)34-21-7-2-8-22-34)45-39-29-15-16-30-40(39)46-44(48)38-28-14-18-32-42(38)50(35-23-9-3-10-24-35)36-25-11-4-12-26-36/h1-14,17-28,31-32,39-40H,15-16,29-30H2,(H,45,47)(H,46,48)/t39-,40-/m0/s1

InChI key

AXMSEDAJMGFTLR-ZAQUEYBZSA-N

Application

Asymmetric allylic alkylation ligand.
Trost Ligands for Asymmetric Allylic Alkylation

Packaging

Bottomless glass bottle. Contents are inside inserted fused cone.

Legal Information

Sold in collaboration with Dr. Reddy′s Laboratories for research purposes only.

Storage Class

11 - Combustible Solids

WGK

WGK 3

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable

PPE (personal protective equipment)

Eyeshields, Gloves, type N95 (US)

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