ChemicalBook--->CAS DataBase List--->135096-78-5

135096-78-5

135096-78-5 Structure

135096-78-5 Structure
IdentificationBack Directory
[Name]

HYDROQUININE 9-PHENANTHRYL ETHER
[CAS]

135096-78-5
[Synonyms]

O-(9-PHENANTHRYL)HYDROQUININE
HYDROQUININE 9-PHENANTHRYL ETHER
Hydroquinine-9-phenanthryl ether 97%
(8α,9R)-10,11-Dihydro-6'-methoxy-9-(9-phenanthrenyloxy)cinchonan
(8α,9R)-10,11-Dihydro-6'-methoxy-9-(9-phenanthrenyloxy)cinchonan
(8α,9R)-10,11-dihydro-6'-Methoxy-9-(9-phenanthrenyloxy)-Cinchonan
Cinchonan, 10,11-dihydro-6'-Methoxy-9-(9-phenanthrenyloxy)-, (8α,9R)-
(2S,4S,5R)-5-Ethyl-2-((R)-(6-methoxyquinolin-4-yl)(phenanthren-9-yloxy)methyl)quinuclidine
[Molecular Formula]

C34H34N2O2
[MDL Number]

MFCD00134566
[MOL File]

135096-78-5.mol
[Molecular Weight]

502.65
Chemical PropertiesBack Directory
[Melting point ]

120 °C (dec.)(lit.)
[Boiling point ]

690.3±40.0 °C(Predicted)
[density ]

1.24±0.1 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[pka]

9?+-.0.70(Predicted)
[Optical Rotation]

[α]20/D +420°, c = 1 in ethanol
[BRN ]

4848702
[InChIKey]

TWOVHUYOMTVDRB-BDCWUMDOSA-N
[SMILES]

CC[C@H]1CN2CCC1CC2[C@H](Oc3cc4ccccc4c5ccccc35)c6ccnc7ccc(OC)cc67
Questions And AnswerBack Directory
[Uses]

Hydrogenated quinidine is also an important pharmaceutical intermediate, but there are few reports on its preparation methods. Existing methods have low product yields and high preparation costs. Hydrogenated quinine-9-phenanthrene ether is a novel hydrogenated quinidine belonging to the quinine alkaloid class of compounds.
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[RIDADR ]

1544
[WGK Germany ]

3
[F ]

9
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[HS Code ]

29392000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Spectrum DetailBack Directory
[Spectrum Detail]

HYDROQUININE 9-PHENANTHRYL ETHER(135096-78-5)1HNMR
HYDROQUININE 9-PHENANTHRYL ETHER(135096-78-5)FT-IR
HYDROQUININE 9-PHENANTHRYL ETHER(135096-78-5)IR
HYDROQUININE 9-PHENANTHRYL ETHER(135096-78-5)Raman
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