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Home Bromides 868387-45-5
868387-45-5,MFCD13195314
Catalog No.:AA003EWW

868387-45-5 | tert-Butyl (4-bromothiophen-2-yl)carbamate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$6.00   $4.00
- +
1g
95%
in stock  
$18.00   $13.00
- +
10g
95%
in stock  
$139.00   $97.00
- +
25g
95%
in stock  
$306.00   $214.00
- +
100g
98%
in stock  
$1,208.00   $846.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003EWW
Chemical Name:
tert-Butyl (4-bromothiophen-2-yl)carbamate
CAS Number:
868387-45-5
Molecular Formula:
C9H12BrNO2S
Molecular Weight:
278.1661
MDL Number:
MFCD13195314
SMILES:
O=C(Nc1scc(c1)Br)OC(C)(C)C
Properties
Properties
 
BP:
279°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
217  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
3.2  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,#19,p.3210-3215

[1]JournalofMedicinalChemistry,2015,vol.58,#12,p.5028-5037

[2]Patent:WO2007/76423,2007,A2,.Locationinpatent:Page/Pagecolumn65

[3]Patent:WO2005/103050,2005,A2,.Locationinpatent:Page/Pagecolumn183-184

[4]Patent:US2007/270386,2007,A1,.Locationinpatent:Page/Pagecolumn36

Downstream Synthesis Route

[1]Patent:US2007/270386,2007,A1.Locationinpatent:Page/Pagecolumn36

[1]JournalofMedicinalChemistry,2015,vol.58,p.5028-5037

[2]Patent:WO2007/76423,2007,A2.Locationinpatent:Page/Pagecolumn65

[3]Patent:WO2005/103050,2005,A2.Locationinpatent:Page/Pagecolumn183-184

[4]Patent:US2007/270386,2007,A1.Locationinpatent:Page/Pagecolumn36

[1]Patent:WO2005/103050,2005,A2.Locationinpatent:Page/Pagecolumn183-184

[2]BioorganicandMedicinalChemistryLetters,2021,vol.33

[1]Patent:WO2007/76423,2007,A2.Locationinpatent:Page/Pagecolumn66

[1]Patent:WO2007/76423,2007,A2.Locationinpatent:Page/Pagecolumn84-85

Literature
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SDS
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Tags:868387-45-5 Molecular Formula|868387-45-5 MDL|868387-45-5 SMILES|868387-45-5 tert-Butyl (4-bromothiophen-2-yl)carbamate |Halogenated_Heterocycles