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80875-98-5,MFCD07782125
Catalog No.:AA003BM4

80875-98-5 | (2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$11.00   $8.00
- +
5g
>97%
in stock  
$25.00   $17.00
- +
10g
95%
in stock  
$30.00   $21.00
- +
25g
>97%
in stock  
$67.00   $47.00
- +
100g
>97%
in stock  
$237.00   $166.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003BM4
Chemical Name:
(2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid
CAS Number:
80875-98-5
Molecular Formula:
C9H15NO2
Molecular Weight:
169.2209
MDL Number:
MFCD07782125
SMILES:
OC(=O)[C@@H]1C[C@H]2[C@@H](N1)CCCC2
Properties
Properties
 
Form:
Solid  
MP:
275-277°C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
193  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-1  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Quotation Request
Company Name:
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Additional Info:
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SDS
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Tags:80875-98-5 Molecular Formula|80875-98-5 MDL|80875-98-5 SMILES|80875-98-5 (2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid
Catalog No.: AA003BM4
80875-98-5,MFCD07782125
80875-98-5 | (2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid
Pack Size： 1g
Purity： 98%
in stock
$11.00 $8.00
Pack Size： 5g
Purity： >97%
in stock
$25.00 $17.00
Pack Size： 10g
Purity： 95%
in stock
$30.00 $21.00
Pack Size： 25g
Purity： >97%
in stock
$67.00 $47.00
Pack Size： 100g
Purity： >97%
in stock
$237.00 $166.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003BM4
Chemical Name: (2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid
CAS Number: 80875-98-5
Molecular Formula: C9H15NO2
Molecular Weight: 169.2209
MDL Number: MFCD07782125
SMILES: OC(=O)[C@@H]1C[C@H]2[C@@H](N1)CCCC2
Properties
Form: Solid  
MP: 275-277°C  
Storage: Keep in dry area;Room Temperature;  
Complexity: 193  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 3  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -1  
Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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