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Home Bromides 174454-41-2
174454-41-2,MFCD22036014
Catalog No.:AA00AN0Z

174454-41-2 | 2-(2-Bromothiophen-3-yl)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$493.00   $345.00
- +
100mg
95%
3 weeks  
$681.00   $477.00
- +
250mg
95%
3 weeks  
$922.00   $645.00
- +
500mg
95%
3 weeks  
$1,388.00   $972.00
- +
1g
95%
3 weeks  
$1,747.00   $1,223.00
- +
2.5g
95%
3 weeks  
$3,313.00   $2,319.00
- +
5g
95%
3 weeks  
$4,847.00   $3,393.00
- +
10g
95%
3 weeks  
$7,131.00   $4,992.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA00AN0Z
Chemical Name:
2-(2-Bromothiophen-3-yl)acetic acid
CAS Number:
174454-41-2
Molecular Formula:
C6H5BrO2S
Molecular Weight:
221.0717
MDL Number:
MFCD22036014
SMILES:
OC(=O)Cc1ccsc1Br
Properties
Computed Properties
 
Complexity:
140  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.1  

Literature

Title: Potent new small-molecule inhibitor of botulinum neurotoxin serotype A endopeptidase developed by synthesis-based computer-aided molecular design.

Journal: PloS one 20090101

Title: Computer-aided lead optimization: improved small-molecule inhibitor of the zinc endopeptidase of botulinum neurotoxin serotype A.

Journal: PloS one 20070101

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SDS
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Tags:174454-41-2 Molecular Formula|174454-41-2 MDL|174454-41-2 SMILES|174454-41-2 2-(2-Bromothiophen-3-yl)acetic acid