Home Amines 93413-44-6
93413-44-6,MFCD07369694
Catalog No.:AA006FVC

93413-44-6 | 1-[(1S)-2-(DIMETHYLAMINO)-1-(4-METHOXYPHENYL)ETHYL]CYCLOHEXANOL

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5mg
95%
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$1,511.00   $1,058.00
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  • Technical Information
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Technical Information
Catalog Number:
AA006FVC
Chemical Name:
1-[(1S)-2-(DIMETHYLAMINO)-1-(4-METHOXYPHENYL)ETHYL]CYCLOHEXANOL
CAS Number:
93413-44-6
Molecular Formula:
C17H27NO2
Molecular Weight:
277.4018
MDL Number:
MFCD07369694
SMILES:
COc1ccc(cc1)[C@H](C1(O)CCCCC1)CN(C)C
Properties
Properties
 
Form:
Solid  
MP:
102-104°C  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
279  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
2.9  

Literature

Title: Field and laboratory studies of the fate and enantiomeric enrichment of venlafaxine and O-desmethylvenlafaxine under aerobic and anaerobic conditions.

Journal: Chemosphere 20120601

Title: Development and validation of a HPLC-MS/MS method for the determination of venlafaxine enantiomers and application to a pharmacokinetic study in healthy Chinese volunteers.

Journal: Biomedical chromatography : BMC 20110301

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

Title: Role of CYP2D6 in the stereoselective disposition of venlafaxine in humans.

Journal: Pharmacogenetics 20030101

Title: Disposition of venlafaxine enantiomers in rats with hepatic encephalopathy after chronic drug treatment.

Journal: Chirality 20020505

Title: Bymaster FP, et al. Comparative affinity of duloxetine and venlafaxine for serotonin and norepinephrine transporters in vitro and in vivo, human serotonin receptor subtypes, and other neuronal receptors. Neuropsychopharmacology. 2001 Dec;25(6):871-80.

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Tags:93413-44-6 Molecular Formula|93413-44-6 MDL|93413-44-6 SMILES|93413-44-6 1-[(1S)-2-(DIMETHYLAMINO)-1-(4-METHOXYPHENYL)ETHYL]CYCLOHEXANOL