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Home Bromides 3166-62-9
3166-62-9,MFCD00210328
Catalog No.:AA00I5XB

3166-62-9 | Methylbenactyzium bromide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$161.00   $113.00
- +
5g
95%
in stock  
$488.00   $342.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00I5XB
Chemical Name:
Methylbenactyzium bromide
CAS Number:
3166-62-9
Molecular Formula:
C21H28BrNO3
Molecular Weight:
422.3559
MDL Number:
MFCD00210328
SMILES:
CC[N+](CCOC(=O)C(c1ccccc1)(c1ccccc1)O)(CC)C.[Br-]
NSC Number:
11525
Properties
Computed Properties
 
Complexity:
389  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
9  

Literature

Title: Bhattacharjee AK, et al. Discovery of subtype selective muscarinic receptor antagonists as alternatives to atropine using in silico pharmacophore modeling and virtual screening methods. Bioorg Med Chem. 2013 May 1;21(9):2651-62.

Title: Nishikawa M, et al. Analysis of methylbenactyzium bromide in human urine by thin-layer chromatography and pyrolysis gas chromatography. Forensic Sci Int. 1991 Mar;49(2):197-203.

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SDS
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