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2786-31-4,MFCD00050297
Catalog No.:AA002UW3

2786-31-4 | Benzothiazolium, 3-methyl-, iodide (1:1)

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$29.00   $20.00
- +
5g
95%
in stock  
$45.00   $32.00
- +
25g
95%
in stock  
$120.00   $84.00
- +
100g
95%
in stock  
$349.00 $245.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002UW3
Chemical Name:
Benzothiazolium, 3-methyl-, iodide (1:1)
CAS Number:
2786-31-4
Molecular Formula:
C8H8INS
Molecular Weight:
277.1253
MDL Number:
MFCD00050297
SMILES:
C[n+]1csc2c1cccc2.[I-]
NSC Number:
141732
Properties
Properties
 
Form:
Solid  
MP:
204 °C  
Solubility:
Soluble in hot methanol- almost transparency.  
Stability:
Light Sensitive  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
126  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route
4209-02-3    2786-31-4   
(4-bromophenyl)(4-methyl-4H-benzob1,4thiazin-2-yl)methanone 

[1]JournalofChemicalResearch,Miniprint,1993,p.2913-2928

31736-73-9    2786-31-4   
(4-bromophenyl(Z)-2,5-dihydro-5-methylbenzb1,4thiazepine-3-yl)methanone 

[1]JournaloftheChineseChemicalSociety,2017,vol.64,p.296-302

Literature
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SDS
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Tags:2786-31-4 Molecular Formula|2786-31-4 MDL|2786-31-4 SMILES|2786-31-4 Benzothiazolium, 3-methyl-, iodide (1:1)
Catalog No.: AA002UW3
2786-31-4,MFCD00050297
2786-31-4 | Benzothiazolium, 3-methyl-, iodide (1:1)
Pack Size： 1g
Purity： 95%
in stock
$29.00 $20.00
Pack Size： 5g
Purity： 95%
in stock
$45.00 $32.00
Pack Size： 25g
Purity： 95%
in stock
$120.00 $84.00
Pack Size： 100g
Purity： 95%
in stock
$349.00 $245.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA002UW3
Chemical Name: Benzothiazolium, 3-methyl-, iodide (1:1)
CAS Number: 2786-31-4
Molecular Formula: C8H8INS
Molecular Weight: 277.1253
MDL Number: MFCD00050297
SMILES: C[n+]1csc2c1cccc2.[I-]
NSC Number: 141732
Properties
Form: Solid  
MP: 204 °C  
Solubility: Soluble in hot methanol- almost transparency.  
Stability: Light Sensitive  
Storage: Room Temperature;  
Complexity: 126  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
4209-02-3    2786-31-4   
(4-bromophenyl)(4-methyl-4H-benzob1,4thiazin-2-yl)methanone 

[1]JournalofChemicalResearch,Miniprint,1993,p.2913-2928

31736-73-9    2786-31-4   
(4-bromophenyl(Z)-2,5-dihydro-5-methylbenzb1,4thiazepine-3-yl)methanone 

[1]JournaloftheChineseChemicalSociety,2017,vol.64,p.296-302

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