Home Other Building Blocks 1097-51-4
1097-51-4,MFCD00055948
Catalog No.:AA003DSP

1097-51-4 | (6aR,6bS,8aS,8bS,9aR,10aS,10bR)-8b-Acetyl-6a,8a-dimethyl-5,6,6a,6b,7,8,8a,8b,9a,10,10a,10b-dodecahydro-1H-naphtho[2',1':4,5]indeno[1,2-b]oxiren-4(2H)-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$213.00   $149.00
- +
5g
98%
in stock  
$593.00   $415.00
- +
25g
98%
in stock  
$1,665.00   $1,165.00
- +
100g
98%
in stock  
$4,404.00   $3,083.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003DSP
Chemical Name:
(6aR,6bS,8aS,8bS,9aR,10aS,10bR)-8b-Acetyl-6a,8a-dimethyl-5,6,6a,6b,7,8,8a,8b,9a,10,10a,10b-dodecahydro-1H-naphtho[2',1':4,5]indeno[1,2-b]oxiren-4(2H)-one
CAS Number:
1097-51-4
Molecular Formula:
C21H28O3
Molecular Weight:
328.4452
MDL Number:
MFCD00055948
SMILES:
O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1C[C@@H]1[C@]2(O1)C(=O)C)C)C
NSC Number:
18315
Properties
Properties
 
BP:
466.9°C at 760 mmHg  
Form:
Solid  
MP:
128-132°C  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
679  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
7  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
1  
XLogP3:
2.9  

Literature

Title: Screening of 397 chemicals and development of a quantitative structure--activity relationship model for androgen receptor antagonism.

Journal: Chemical research in toxicology 20080401

Title: Effects of environmentally encountered epoxides on mouse liver epoxide-metabolizing enzymes.

Journal: Biochemical pharmacology 19910601

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SDS
Tags:1097-51-4 Molecular Formula|1097-51-4 MDL|1097-51-4 SMILES|1097-51-4 (6aR,6bS,8aS,8bS,9aR,10aS,10bR)-8b-Acetyl-6a,8a-dimethyl-5,6,6a,6b,7,8,8a,8b,9a,10,10a,10b-dodecahydro-1H-naphtho[2',1':4,5]indeno[1,2-b]oxiren-4(2H)-one