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165947-52-4,MFCD08752873
Catalog No.:AA001WCJ

165947-52-4 | tert-Butyl 4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$15.00   $11.00
- +
250mg
98%
in stock  
$28.00   $19.00
- +
1g
98%
in stock  
$41.00   $29.00
- +
5g
98%
in stock  
$203.00   $142.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001WCJ
Chemical Name:
tert-Butyl 4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate
CAS Number:
165947-52-4
Molecular Formula:
C12H17NO2S
Molecular Weight:
239.3339
MDL Number:
MFCD08752873
SMILES:
O=C(N1CCc2c(C1)scc2)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
275  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.4  

Upstream Synthesis Route

[1]Patent:US5998433,1999,A,

[1]Patent:CN104497008,2016,B,.Locationinpatent:Paragraph0242;0244;0245

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,#17,p.3004-3008

[1]JournalofMedicinalChemistry,2014,vol.57,#9,p.3687-3706

[1]JournalofMedicinalChemistry,2014,vol.57,#9,p.3687-3706

Downstream Synthesis Route

[1]Patent:US6518423,2003,B1

[1]Patent:US5998433,1999,A

[1]Patent:CN104497008,2016,B.Locationinpatent:Paragraph0242;0244;0245

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,p.3004-3008

Literature
Quotation Request
Company Name:
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Contact Person:
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Email:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:165947-52-4 Molecular Formula|165947-52-4 MDL|165947-52-4 SMILES|165947-52-4 tert-Butyl 4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate
Catalog No.: AA001WCJ
165947-52-4,MFCD08752873
165947-52-4 | tert-Butyl 4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate
Pack Size： 100mg
Purity： 98%
in stock
$15.00 $11.00
Pack Size： 250mg
Purity： 98%
in stock
$28.00 $19.00
Pack Size： 1g
Purity： 98%
in stock
$41.00 $29.00
Pack Size： 5g
Purity： 98%
in stock
$203.00 $142.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001WCJ
Chemical Name: tert-Butyl 4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate
CAS Number: 165947-52-4
Molecular Formula: C12H17NO2S
Molecular Weight: 239.3339
MDL Number: MFCD08752873
SMILES: O=C(N1CCc2c(C1)scc2)OC(C)(C)C
Properties
Complexity: 275  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.4  
Upstream Synthesis Route
165947-52-4    28783-38-2 

[1]Patent:US5998433,1999,A,

24424-99-5    28783-38-2    165947-52-4 

[1]Patent:CN104497008,2016,B,.Locationinpatent:Paragraph0242;0244;0245

62019-71-0    24424-99-5    165947-52-4 

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,#17,p.3004-3008

50-00-0    165947-52-4 

[1]JournalofMedicinalChemistry,2014,vol.57,#9,p.3687-3706

24424-99-5    165947-52-4 

[1]JournalofMedicinalChemistry,2014,vol.57,#9,p.3687-3706

Downstream Synthesis Route
165947-52-4    110-18-9    203663-30-3 

[1]Patent:US6518423,2003,B1

165947-52-4    28783-38-2 

[1]Patent:US5998433,1999,A

24424-99-5    28783-38-2    165947-52-4 

[1]Patent:CN104497008,2016,B.Locationinpatent:Paragraph0242;0244;0245

59311-67-0    165947-52-4 

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,p.3004-3008

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