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Merck
CN

700592

(1R,2R)-N,N′-Dihydroxy-N,N′-bis(diphenylacetyl)-1,2-cyclohexanediamine

97%

Synonym(s):

(1R,2R)-N,N′-1,2-cyclohexanediylbis[N-hydroxy-α-phenyl-benzeneacetamide], (1R,2R)-N,N′-Dihydroxy-N,N′-bis(diphenylacetyl)-cyclohexane-1,2-diamine, (R)-CBHA-DPA

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About This Item

Empirical Formula (Hill Notation):
C34H34N2O4
CAS Number:
Molecular Weight:
534.64
UNSPSC Code:
12352116
PubChem Substance ID:
MDL number:
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InChI

1S/C34H34N2O4/c37-33(31(25-15-5-1-6-16-25)26-17-7-2-8-18-26)35(39)29-23-13-14-24-30(29)36(40)34(38)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28/h1-12,15-22,29-32,39-40H,13-14,23-24H2/t29-,30-/m1/s1

SMILES string

ON([C@@H]1CCCC[C@H]1N(O)C(=O)C(c2ccccc2)c3ccccc3)C(=O)C(c4ccccc4)c5ccccc5

InChI key

FSKBHXVAXWHEQT-LOYHVIPDSA-N

assay

97%

optical activity

[α]22/D +90.0°, c = 1 in chloroform

mp

200-205 °C

pictograms

Skull and crossbones

signalword

Danger

hcodes

Hazard Classifications

Acute Tox. 3 Oral

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges

Regulatory Information

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Vanadium-catalyzed asymmetric epoxidation of homoallylic alcohols.
Wei Zhang et al.
Journal of the American Chemical Society, 129(2), 286-287 (2007-01-11)
Enantioselective epoxidation of allylic alcohols by a chiral complex of vanadium: an effective controller system and a rational mechanistic model.
Wei Zhang et al.
Angewandte Chemie (International ed. in English), 44(28), 4389-4391 (2005-06-09)

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