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139239-49-9,MFCD12756085
Catalog No.:AA001AHF

139239-49-9 | Cinchonan-9-ol, 3,10-didehydro-10,11-dihydro-6'-methoxy-, acetate (ester), (9S)- (9CI)

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Purity
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10mg
2 weeks  
$1,929.00   $1,350.00
- +
100mg
2 weeks  
$4,225.00   $2,958.00
- +
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Technical Information
Catalog Number:
AA001AHF
Chemical Name:
Cinchonan-9-ol, 3,10-didehydro-10,11-dihydro-6'-methoxy-, acetate (ester), (9S)- (9CI)
CAS Number:
139239-49-9
Molecular Formula:
C22H26N2O3
Molecular Weight:
366.4534
MDL Number:
MFCD12756085
SMILES:
C/C=C/1\CN2CCC1C[C@@H]2[C@H](c1ccnc2c1cc(OC)cc2)OC(=O)C
Properties
Computed Properties
 
Complexity:
578  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
5  
XLogP3:
2.8  

Literature
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SDS
Tags:139239-49-9 Molecular Formula|139239-49-9 MDL|139239-49-9 SMILES|139239-49-9 Cinchonan-9-ol, 3,10-didehydro-10,11-dihydro-6'-methoxy-, acetate (ester), (9S)- (9CI)