AG0019CL

138517-61-0 | Benzamide, N,N'-(1R,2R)-1,2-cyclohexanediylbis[2-(diphenylphosphino)-

AG0019CL

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CAS Number	138517-61-0
Catalog Number	AG0019CL(AGN-PC-0PMW6I)
Chemical Name	Benzamide, N,N'-(1R,2R)-1,2-cyclohexanediylbis[2-(diphenylphosphino)-
IUPAC Name	2-diphenylphosphanyl-N-[(1R,2R)-2-[(2-diphenylphosphanylbenzoyl)amino]cyclohexyl]benzamide
InChI	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
InChI Key	AXMSEDAJMGFTLR-XRSDMRJBSA-N
MDL Number	MFCD01631273
Molecular Formula	C44H40N2O2P2
Molecular Weight	690.7481
SMILES	O=C(c1ccccc1P(c1ccccc1)c1ccccc1)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1P(c1ccccc1)c1ccccc1
Synonyms	(R,R)-DACH-phenyl Trost ligand, 138517-61-0, (1R,2R)-(+)-1,2-DIAMINOCYCLOHEXANE-N,N'-BIS(2'-DIPHENYLPHOSPHINOBENZOYL), (1R,2R)-(+)-1,2-DIAMINOCYCLOHEXANE-N,N'-BIS(2-DIPHENYLPHOSPHINOBENZOYL), (1R,2R)-(+)-N,N'-BIS(2-DIPHENYLPHOSPHINOBENZOYL)-1,2-DIAMINOCYCLOHEXANE, MFCD01631273, (R,R)-Trost's ligand, AC1MC1FQ, SCHEMBL2252584, Benzamide, N,N'-(1R,2R)-1,2-cyclohexanediylbis[2-(diphenylphosphino)-, CTK0G9843, ZINC95713524, AKOS015917837, CD-1414, SC11302, (R,R)-DACH-phenyl Trost ligand, 95%, 517D610, I14-8989, J-007150, (1R,2R)-(+)-1,2-Diaminocyclohexane-N,N'-bis(2'-di-phenylphoshinobenzoyl), (R,R)-1,2-BIS(AMINOCARBONYLPHENYL-2'-DIPHENYLPHOSPHINO)CYCLOHEXANE, N,N'-((1R,2R)-cyclohexane-1,2-diyl)bis(2-(diphenylphosphino)benzamide), 2-diphenylphosphanyl-N-[(1R,2R)-2-[(2-diphenylphosphanylbenzoyl)amino]cyclohexyl]benzamide, (1R,2R)-(+)-1,2-Diaminocyclohexane-N,N inverted exclamation marka-bis(2-diphenylphosphinobenzoyl), (1R,2R)-(+)-1,2-Diaminocyclohexane-N,N'-bis(2'-diphenylphosphinobenzoyl),? (R,R)-DACH-Phenyl Trost Ligand, Trost ligand, CID2734568, (1S,2S)-(-)-1,2-DIAMINOCYCLOHEXANE-N,N'-BIS(2'-DIPHENYLPHOSPHINOBENZOYL), 2-diphenylphosphanyl-N-[2-[(2-diphenylphosphanylbenzoyl)amino]cyclohexyl]benzamide, (1R,2R)-(+)-1,2-Diaminocyclohexane-N,N'-bis(2'-diphenylphosphinobenzoyl), (R,R)-DACH-Phenyl Trost Ligand, 169689-05-8,

Complexity	929
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	690.257g/mol
Formal Charge	0
Heavy Atom Count	50
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	690.764g/mol
Monoisotopic Mass	690.257g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	58.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	8.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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