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Home Carboxes 910-31-6
910-31-6,MFCD00003632
Catalog No.:AA003OSK

910-31-6 | (8S,9S,10R,13R,14S,17R)-3-Chloro-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$27.00   $19.00
- +
5g
95%
in stock  
$45.00   $32.00
- +
25g
95%
in stock  
$100.00   $70.00
- +
100g
95%
in stock  
$261.00   $183.00
- +
500g
>95.0%(HPLC)
in stock  
$1,157.00   $810.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003OSK
Chemical Name:
(8S,9S,10R,13R,14S,17R)-3-Chloro-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
CAS Number:
910-31-6
Molecular Formula:
C27H45Cl
Molecular Weight:
405.0992
MDL Number:
MFCD00003632
SMILES:
CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CCC(C2)Cl)C)C
NSC Number:
2084
Properties
Properties
 
BP:
488.29°C (rough estimate)  
Form:
Solid  
MP:
94-96 °C(lit.)  
Refractive Index:
1.6281 (estimate)  
Storage:
Room Temperature;Keep in dry area;  

Computed Properties
 
Complexity:
591  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
8  
Heavy Atom Count:
28  
Rotatable Bond Count:
5  
XLogP3:
9.8  

Downstream Synthesis Route

[1]JournalofOrganicChemistry,1948,vol.13,p.837,840

[1]AngewandteChemie-InternationalEdition,2016,vol.55,p.10145-10149    Angew.Chem.,2016,vol.128,p.10300-10304,5

[2]Patent:WO2016/202894,2016,A1.Locationinpatent:Page/Pagecolumn51;144;147;181

Literature

Title: Microscopic vs. macroscopic origin of the Lehmann effect in cholesteric liquid crystals.

Journal: The European physical journal. E, Soft matter 20120201

Title: Solvent vapour detection with cholesteric liquid crystals--optical and mass-sensitive evaluation of the sensor mechanism.

Journal: Sensors (Basel, Switzerland) 20100101

Title: Practical synthesis of 3beta-amino-5-cholestene and related 3beta-halides involving i-steroid and retro-i-steroid rearrangements.

Journal: Organic letters 20090205

Title: Inhibitory effects of cholesterol derivatives on DNA polymerase and topoisomerase activities, and human cancer cell growth.

Journal: Lipids 20080401

Title: Cholesterol hemisuccinate: a selective inhibitor of family X DNA polymerases.

Journal: Biochemical and biophysical research communications 20070309

Title: Validation of a one-step extraction/methylation method for determination of fatty acids and cholesterol in marine tissues.

Journal: Journal of chromatography. A 20060203

Title: Electrochemical bromination of cholest-5-enes.

Journal: Steroids 20051201

Title: Theoretical mechanism of the formation of cholesteryl chloride from cholesterol and thionyl chloride.

Journal: Journal of molecular modeling 20050301

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SDS
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Tags:910-31-6 Molecular Formula|910-31-6 MDL|910-31-6 SMILES|910-31-6 (8S,9S,10R,13R,14S,17R)-3-Chloro-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene