456705

(DHQ)₂AQN

95%

• Synonym(s): Hydroquinine anthraquinone-1,4-diyl diether
• Empirical Formula (Hill Notation): C₅₄H₅₆N₄O₆
• CAS Number: 176097-24-8
• Molecular Weight: 857.05
• MDL number: MFCD00467215
• UNSPSC Code: 12352005
• PubChem Substance ID: 329756884
• NACRES: NA.22

Properties

• Assay: 95%
• form: solid
• optical activity: [α]20/D +495°, c = 1 in chloroform
• mp: 175-180 °C (lit.)
• functional group: ketone
• SMILES string: CC[C@@H]1CN2CC[C@H]1C[C@@H]2[C@H](Oc3ccc(O[C@@H]([C@H]4C[C@@H]5CCN4C[C@H]5CC)c6ccnc7ccc(OC)cc67)c8C(=O)c9ccccc9C(=O)c38)c%10ccnc%11ccc(OC)cc%10%11
• InChI: 1S/C54H56N4O6/c1-5-31-29-57-23-19-33(31)25-45(57)53(39-17-21-55-43-13-11-35(61-3)27-41(39)43)63-47-15-16-48(50-49(47)51(59)37-9-7-8-10-38(37)52(50)60)64-54(46-26-34-20-24-58(46)30-32(34)6-2)40-18-22-56-44-14-12-36(62-4)28-42(40)44/h7-18,21-22,27-28,31-34,45-46,53-54H,5-6,19-20,23-26,29-30H2,1-4H3/t31-,32-,33+,34+,45-,46-,53-,54-/m1/s1
• InChI key: ARCFYUDCVYJQRN-KGHNJIHGSA-N

Description

Application

Superior ligand for asymmetric dihydroxylation reactions of most olefins bearing aliphatic substituents or olefins having heteroatoms in the allylic position.

Legal Information

Sold under license from Rhodia Pharma Solutions.

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H315,H319,H335
• Precautionary Statements: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves