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Details

Stereochemistry ABSOLUTE
Molecular Formula C44H40N2O2P2
Molecular Weight 690.7481
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TROST LIGAND, (R,R)-

SMILES

O=C(N[C@@H]1CCCC[C@H]1NC(=O)C2=C(C=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4)C5=C(C=CC=C5)P(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChIKey=AXMSEDAJMGFTLR-XRSDMRJBSA-N
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-/m1/s1

HIDE SMILES / InChI

Molecular Formula C44H40N2O2P2
Molecular Weight 690.7481
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:02:14 GMT 2023
Edited
by admin
on Sat Dec 16 18:02:14 GMT 2023
Record UNII
M4RRX95R5F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TROST LIGAND, (R,R)-
Common Name English
TROST LIGAND
Common Name English
BENZAMIDE, N,N-1,2-CYCLOHEXANEDIYLBIS(2-(DIPHENYLPHOSPHINO)-, (1R-TRANS)-
Systematic Name English
(1R,2R)-(+)-1,2-DIAMINOCYCLOHEXANE-N,N-BIS(2-DIPHENYLPHOSPHINOBENZOYL)
Systematic Name English
(R,R)-TROST LIGAND
Common Name English
(1R,2R)-1,2-BIS((2-(DIPHENYLPHOSPHINO)BENZOYL)AMINO)CYCLOHEXANE
Systematic Name English
(R,R)-DPPBA
Common Name English
(1R,2R)-1,2-BIS((2-(DIPHENYLPHOSPHANYL)BENZOYL)AMINO)CYCLOHEXANE
Systematic Name English
N,N-(1R,2R)-1,2-CYCLOHEXANEDIYLBIS(2-(DIPHENYLPHOSPHINO)BENZAMIDE)
Systematic Name English
(R)-TROST LIGAND
Common Name English
BENZAMIDE, N,N-(1R,2R)-1,2-CYCLOHEXANEDIYLBIS(2-(DIPHENYLPHOSPHINO)-
Systematic Name English
(1R,2R)-N,N-BIS(O-(DIPHENYLPHOSPHINO)BENZOYL)CYCLOHEXANE-1,2-DIAMINE
Systematic Name English
Code System Code Type Description
CAS
138517-61-0
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
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EPA CompTox
DTXSID80894121
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
PRIMARY
FDA UNII
M4RRX95R5F
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
PRIMARY
PUBCHEM
2734568
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
PRIMARY
WIKIPEDIA
Trost ligand
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
PRIMARY