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Home Thiazoles 58980-39-5
58980-39-5,MFCD13194723
Catalog No.:AA00EJ80

58980-39-5 | 2,3,4,5-Tetrahydrobenzo[f][1,4]thiazepine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$382.00   $268.00
- +
250mg
98%
in stock  
$577.00   $404.00
- +
1g
98%
in stock  
$1,192.00   $834.00
- +
5g
98%
in stock  
$3,454.00   $2,418.00
- +
10g
98%
in stock  
$5,108.00   $3,576.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00EJ80
Chemical Name:
2,3,4,5-Tetrahydrobenzo[f][1,4]thiazepine
CAS Number:
58980-39-5
Molecular Formula:
C9H11NS
Molecular Weight:
165.2553
MDL Number:
MFCD13194723
SMILES:
C1CSc2c(CN1)cccc2
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
127  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
XLogP3:
1.6  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,2018,vol.61,p.10228-10241

[2]ZeitschriftfurChemie,1967,vol.7,p.185-186

[3]JournalofMedicinalChemistry,1996,vol.39,p.3539-3546

[4]Patent:US2013/90328,2013,A1.Locationinpatent:Paragraph0106;0107

[5]Patent:WO2013/53658,2013,A1.Locationinpatent:Page/Pagecolumn16

[6]Patent:EP3782995,2021,A1.Locationinpatent:Paragraph0048;0052

1677-50-5    58980-39-5   
C18H14Cl2N2S 

[1]JournalofMedicinalChemistry,2019,vol.62,p.6315-6329

Literature
Quotation Request
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Additional Info:
SDS
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Tags:58980-39-5 Molecular Formula|58980-39-5 MDL|58980-39-5 SMILES|58980-39-5 2,3,4,5-Tetrahydrobenzo[f][1,4]thiazepine