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942939-38-0

942939-38-0 Structure

942939-38-0 Structure
IdentificationBack Directory
[Name]

5-(11bS)-Dinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin-4-yl-5H-dibenz[b,f]azepine
[CAS]

942939-38-0
[Synonyms]

(S)-(+)-N-(3,5-Dioxa-4-phosphacyclohepta[2,1-a
3,4-a']dinaphthalen-4-yl)-5H-dibenz[b,f]azepine
3,4-a']dinaphthalen-4-yl)-5H-dibenz[b,f]azepine,min.97%
3,4-a']dinaphthalen-4-yl)-5H-dibenz[b,f]azepine, min. 97%
3,4-a']dinaphthalen-4-yl)-dibenzo[b,f]azepine >=95% (elemental analysis)
5-(11bS)-Dinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin-4-yl-5H-dibenz[b,f]azepine
(S)-(+)-N-(3,5-Dioxa-4-phosphacyclohepta[2,1-a,3,4-a′]dinaphthalen-4-yl)-dibenzo[b,f]azepine
(S)-(+)-(3,5-Dioxa-4-phosphacyclohepta[2,1-a:3,4-a']dinaphthalen-4-yl)-5H-dibenz[b,f]azepine, min. 97%
[Molecular Formula]

C34H22NO2P
[MDL Number]

MFCD22666424
[MOL File]

942939-38-0.mol
[Molecular Weight]

507.53
Chemical PropertiesBack Directory
[Melting point ]

246 °C
[Boiling point ]

711.5±63.0 °C(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

solid
[pka]

-2.70±0.20(Predicted)
[color ]

yellow
[Optical Rotation]

319.350°(C=1.0039g/100ml CHCL3)
[Sensitive ]

air sensitive, moisture sensitive
[InChI]

1S/C34H22NO2P/c1-5-13-27-23(9-1)19-21-31-33(27)34-28-14-6-2-10-24(28)20-22-32(34)37-38(36-31)35-29-15-7-3-11-25(29)17-18-26-12-4-8-16-30(26)35/h1-22H
[InChIKey]

KOVOHCVLXRKTGN-UHFFFAOYSA-N
[SMILES]

C1(C=CC=C2)=C2C(C3=C(C=CC=C4)C4=CC=C3OP5N6C7=C(C=CC=C7)C=CC8=C6C=CC=C8)=C(O5)C=C1
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Questions And AnswerBack Directory
[Reaction]

  1. The ligand is used in the stereodivergent α-allylation of linear aldehydes with dual iridium and amine catalysis.
  2. The ligand used in the direct, enantioselective iridium-catalyzed amination and (thio-) etherification of racemic allylic alcohols.
  3. The ligand used in an asymmetric, rhodium-catalyzed, intramolecular hydroacylation reaction. 
Reactions of 942939-38-0
Hazard InformationBack Directory
[Uses]

Phosphorous precursor for ligand synthesis
Spectrum DetailBack Directory
[Spectrum Detail]

5-(11bS)-Dinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin-4-yl-5H-dibenz[b,f]azepine(942939-38-0)1HNMR
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