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Home Aldehydes 5381-20-4
5381-20-4,MFCD00052376
Catalog No.:AA0032LM

5381-20-4 | Benzo[b]thiophene-3-carbaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$7.00   $5.00
- +
1g
97%
in stock  
$11.00   $8.00
- +
5g
95%
in stock  
$35.00   $25.00
- +
25g
97%
in stock  
$112.00   $78.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0032LM
Chemical Name:
Benzo[b]thiophene-3-carbaldehyde
CAS Number:
5381-20-4
Molecular Formula:
C9H6OS
Molecular Weight:
162.2083
MDL Number:
MFCD00052376
SMILES:
O=Cc1csc2c1cccc2
NSC Number:
18872
Properties
Properties
 
BP:
303.2°C at 760 mmHg  
Form:
Solid  
MP:
53-57 °C(lit.)  
Refractive Index:
1.5500 (estimate)  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
158  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
2.6  

Literature

Title: (E)-N-(1-Benzothio-phen-3-yl-methyl-idene)-2,6-dimethyl-aniline.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: (E)-3-[(2-Methyl-4-nitro-phen-yl)imino-meth-yl]-1-benzothio-phene.

Journal: Acta crystallographica. Section E, Structure reports online 20120201

Title: Identification of novel CYP2A6 inhibitors by virtual screening.

Journal: Bioorganic & medicinal chemistry 20111201

Title: Microwave assisted synthesis of novel functionalized hydantoin derivatives and their conversion to 5-(Z) arylidene-4H-imidazoles.

Journal: Molecules (Basel, Switzerland) 20110629

Title: Synthesis and evaluation of benzo[b]thiophene derivatives as inhibitors of alkaline phosphatases.

Journal: Bioorganic & medicinal chemistry 20091015

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SDS
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Tags:5381-20-4 Molecular Formula|5381-20-4 MDL|5381-20-4 SMILES|5381-20-4 Benzo[b]thiophene-3-carbaldehyde